added code

This commit is contained in:
Alex Blank
2025-05-19 11:11:04 +02:00
parent 75db81367c
commit 50cf43b9fe
95 changed files with 7333 additions and 0 deletions
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install.package("cpm")
install.packages("cpm")
install.packages("cpm")
install.packages("signal", "zoo", "pracma")
install.packages("signal", "zoo", "pracma")
install.packages("signal", "pracma")
install.packages("signal")
install.packages("signal")
install.packages("signal", "zoo", "pracma")
install.packages("zoo", "pracma")
install.packages("pracma")
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LOG_DIR=/home/alex/projects/datascience-analysis/notebooks/logs
LMDB_ROOT_DIR=/home/alex/projects/datascience-analysis/notebooks/lmdb_datasets
RESULTS_ROOT_DIR=/home/alex/projects/datascience-analysis/notebooks/results
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from functools import partial
from configs.feature_config import feature_config
from models.cnn import CNNTransformer
from utils.data_utils import *
from utils.training import *
from models.lstm import *
from models.utils import *
from models.collation import *
take_every_nth = int(288 / 12)
shift_in_hours = 12
input_window_length = (288 // take_every_nth) * 80
# output_window_length = (288 // take_every_nth) * 1
output_window_length = 1
output_window_offset = input_window_length + (288 // take_every_nth) * 0
window_shift = int((288 // take_every_nth) / 24 * shift_in_hours)
min_input_length_fraction_for_padding = ((288 // take_every_nth) * 4) / input_window_length
max_lr = 1e-5
batch_size = 256
def get_cnn_run_config(
run_name: str,
run_description: str,
input_window_length: int,
output_window_length: int,
take_every_nth: int,
shift_in_hours: int,
output_window_offset: int,
batch_size: int,
model_parameters: dict,
max_lr: float,
num_epochs: int,
patience: int,
feature_config: dict):
"""
Get the configuration for the CNN model
Returns:
run_configuration: configuration for the CNN model
"""
base_model_config = {
"model_name": "cnn_regressor",
"version": "1.0.0",
"model_class": CNNTransformer,
"feature_config": feature_config | {"ignored_features":
[
"fertility_probability",
"ov_over_probability",
# "days_relative_to_ov",
# "is_biphasic",
"ov_day",
]},
"preprocessing": {
"window_shift": int((288 // take_every_nth) / 24 * shift_in_hours),
"take_every_nth": take_every_nth,
"min_input_length_fraction_for_padding": ((288 // take_every_nth) * 4) / input_window_length,
},
"batch_fn": produce_window_batches,
"collate_fn": simple_x_y_collate,
"model_creation_fn": simple_model_creation,
"model_save_fn": simple_model_save,
"model_load_fn": partial(simple_model_load, model_creation_fn=simple_model_creation),
"batch_loss_fn": get_model_loss,
"actual_fn": simple_get_y,
"predict_fn": simple_x_y_predict,
"model_parameters": {
**model_parameters | {"seq_len": input_window_length},
},
"input_window_length": input_window_length,
"output_window_length": output_window_length,
"output_window_offset": output_window_offset,
}
base_training_config = {
"batch_size": batch_size,
"model_class": CNNTransformer,
"learning_parameters": {
"learning_rate": max_lr * (batch_size / 4),
"epochs": num_epochs,
"patience": patience
},
"loss_functions": [
nn.MSELoss(),
nn.BCEWithLogitsLoss(),
],
"max_grad_norm": 1.0,
"train_size": 0.7,
"val_size": 0.15,
"test_size": 0.15,
}
return {
"name": run_name,
"description": run_description,
"model_configuration": base_model_config,
"training_configuration": base_training_config,
}
run_configuration = {
"runs": [
get_cnn_run_config(
run_name="cnn_ovulation_regression",
run_description="CNN model for ovulation regression",
input_window_length=input_window_length,
output_window_length=output_window_length,
take_every_nth=take_every_nth,
shift_in_hours=shift_in_hours,
output_window_offset=output_window_offset,
batch_size=batch_size,
model_parameters={
"cnn_channels": 64,
"kernel_size": 3,
"embed_dim": 64,
"num_enc_layers": 2,
"num_heads": 2,
},
max_lr=max_lr,
num_epochs=10,
patience=3,
feature_config=feature_config,
)
]
}
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from typing import Callable
import configs
from configs.feature_config import feature_config
from configs.cnn_run_config import get_cnn_run_config
from configs.transformer_run_config import get_transformer_run_config
take_every_nth = int(288 / 12)
shift_in_hours = 12
input_window_length = (288 // take_every_nth) * 80
# output_window_length = (288 // take_every_nth) * 1
output_window_length = 1
output_window_offset = input_window_length + (288 // take_every_nth) * 0
window_shift = int((288 // take_every_nth) / 24 * shift_in_hours)
min_input_length_fraction_for_padding = ((288 // take_every_nth) * 4) / input_window_length
def config_generator(config_gen_fn: Callable,
fixed_params: dict,
variable_param_configs: list,
) -> list:
configs = list()
for variable_config in variable_param_configs:
config = fixed_params.copy()
for param_name, param_value in variable_config.items():
# update the config with the variable parameter, values can be None, if default should be used
if param_value is not None:
config[param_name] = param_value
configs.append(config_gen_fn(**config))
return configs
run_configuration = {
"name": "ovulation_regression",
"runs": config_generator(
get_cnn_run_config,
fixed_params={
"run_name": "cnn_ovulation_regression",
"run_description": "CNN model for ovulation regression",
"input_window_length": input_window_length,
"output_window_length": output_window_length,
"take_every_nth": take_every_nth,
"shift_in_hours": shift_in_hours,
"output_window_offset": output_window_offset,
"batch_size": 256,
"max_lr": 1e-5,
"num_epochs": 10,
"patience": 3,
"feature_config": feature_config,
},
variable_param_configs=[
{
"model_parameters": {
"cnn_channels": 32,
"kernel_size": 3,
"embed_dim": 32,
"num_enc_layers": 2,
"num_heads": 2,
},
},
{
"model_parameters": {
"cnn_channels": 64,
"kernel_size": 3,
"embed_dim": 64,
"num_enc_layers": 2,
"num_heads": 2,
},
},
{
"batch_size": 128,
"model_parameters": {
"cnn_channels": 128,
"kernel_size": 5,
"embed_dim": 128,
"num_enc_layers": 4,
"num_heads": 4,
},
},
]
) + config_generator(
get_transformer_run_config,
fixed_params={
"run_name": "transformer_ovulation_regression",
"run_description": "Transformer model for ovulation regression",
"input_window_length": input_window_length,
"output_window_length": output_window_length,
"take_every_nth": take_every_nth,
"shift_in_hours": shift_in_hours,
"output_window_offset": output_window_offset,
"batch_size": 128,
"max_lr": 1e-5,
"num_epochs": 10,
"patience": 3,
"feature_config": feature_config,
},
variable_param_configs=[
{
"model_parameters": {
"embed_dim": 64,
"num_enc_layers": 2,
"num_heads": 2,
},
},
{
"batch_size": 64,
"model_parameters": {
"embed_dim": 128,
"num_enc_layers": 4,
"num_heads": 4,
},
},
{
"batch_size": 64,
"model_parameters": {
"embed_dim": 256,
"num_enc_layers": 4,
"num_heads": 4,
},
},
{
"batch_size": 32,
"model_parameters": {
"embed_dim": 512,
"num_enc_layers": 4,
"num_heads": 4,
},
},
]
)
}
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import os
from functools import partial
import math
import torch
from torch import nn
import numpy as np
from sklearn.preprocessing import StandardScaler, MinMaxScaler, RobustScaler
from torch.optim.lr_scheduler import OneCycleLR
from torch.optim import AdamW
from data_analysis.models.ov_detection.config import model_config
from utils.feature_functions import *
from utils.loss_functions import weighted_bce_loss_fn
from utils.training_utils import collate
from vsm_datascience_common import constants
feature_config = {
"feature_set_name": "full_feature_set",
"filter_criteria": {
"measurements.length": {
"$gt": constants.MEASUREMENTS_PER_DAY * 10,
"$lt": constants.MEASUREMENTS_PER_DAY * 150
},
"ends_at": {
"$exists": True,
"$ne": None
},
"$and": [
{"measurements.values": {"$not": {"$elemMatch": {"$lt": 35}}}},
{"measurements.values": {"$not": {"$elemMatch": {"$gt": 43}}}}
]
},
"augmentation": {
"use_augmentation": True,
"max_lookback": 4,
},
"feature_sets": [
"static_categorical_features",
"static_continuous_features",
"known_categorical_features",
"known_continuous_features",
"observed_categorical_features",
"observed_continuous_features",
"target_features"
],
"static_categorical_features": [
],
"static_continuous_features": [
{
"name": "average_cycle_length",
"fn": get_cycle_length_stats,
"scaler": RobustScaler
},
{
"name": "average_ovulation_day",
"fn": get_average_ovulation_day,
"scaler": RobustScaler
},
{
"name": "ovulation_std",
"fn": get_ovulation_std,
"scaler": StandardScaler
},
{
"name": "biphasic_fraction",
"fn": get_biphasic_fraction,
"scaler": MinMaxScaler
},
{
"name": "num_cycles",
"fn": get_num_cycles,
"scaler": RobustScaler
},
{
"name": "temperature_averages",
"fn": get_average_temperatures,
"scaler": StandardScaler
}
],
"known_categorical_features": [
],
"known_continuous_features": [
{
"name": "hours_from_start",
"fn": partial(get_hours_from_start, shift=0),
"scaler": MinMaxScaler,
"accumulation_fn": np.max
},
{
"name": "hour_of_day",
"fn": partial(get_hour_of_day_encoded, shift=0),
"scaler": None,
"accumulation_fn": np.max
},
{
"name": "day_of_week",
"fn": partial(get_day_of_week_encoded, shift=0),
"scaler": None,
"accumulation_fn": np.max
},
{
"name": "month_of_year",
"fn": partial(get_month_of_year_encoded, shift=0),
"scaler": None,
"accumulation_fn": np.max
}
],
"observed_categorical_features": [
],
"observed_continuous_features": [
{
"name": "temperature",
"fn": partial(get_temperature, shift=0),
"scaler": StandardScaler
},
{
"name": "rolling_average_temperature",
"fn": partial(get_rolling_average_with_padding, shift=0),
"scaler": StandardScaler
},
{
"name": "rolling_window_temperature_min",
"fn": partial(get_window_fn, window_size=constants.MEASUREMENTS_PER_DAY, fn=partial(np.min, axis=1)),
"scaler": StandardScaler
},
{
"name": "rolling_window_temperature_max",
"fn": partial(get_window_fn, window_size=constants.MEASUREMENTS_PER_DAY, fn=partial(np.max, axis=1)),
"scaler": StandardScaler
},
],
"target_features": [
# {
# "name": "fertility_probability",
# "fn": partial(get_fertility_probability, shift=0),
# "scaler": MinMaxScaler,
# "accumulation_fn": np.max
# },
# {
# "name": "ov_over_probability",
# "fn": partial(get_ov_over_probability, shift=0),
# "scaler": MinMaxScaler,
# "accumulation_fn": np.max
# },
{
"name": "days_relative_to_ov",
"fn": get_days_relative_to_ov,
"scaler": RobustScaler,
"accumulation_fn": np.max
},
{
"name": "ov_day",
"fn": get_ov_day,
"scaler": RobustScaler,
"accumulation_fn": np.max
},
{
"name": "is_biphasic",
"fn": get_is_biphasic,
"scaler": MinMaxScaler,
"accumulation_fn": np.max
}
]
}
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from functools import partial
from configs.feature_config import feature_config
from utils.data_utils import *
from utils.training import *
from models.lstm import *
from models.utils import *
from models.collation import *
take_every_nth = int(288 / 12)
shift_in_hours = 12
input_window_length = (288 // take_every_nth) * 80
# output_window_length = (288 // take_every_nth) * 1
output_window_length = 1
output_window_offset = input_window_length + (288 // take_every_nth) * 0
window_shift = int((288 // take_every_nth) / 24 * shift_in_hours)
min_input_length_fraction_for_padding = ((288 // take_every_nth) * 4) / input_window_length
max_lr = 1e-5
batch_size = 128
def get_lstm_run_config(
run_name: str,
run_description: str,
input_window_length: int,
output_window_length: int,
take_every_nth: int,
shift_in_hours: int,
output_window_offset: int,
batch_size: int,
model_parameters: dict,
max_lr: float,
num_epochs: int,
patience: int,
feature_config: dict):
"""
Get the configuration for the LSTM model
Returns:
run_configuration: configuration for the LSTM model
"""
base_model_config = {
"model_name": "lstm_regressor",
"version": "1.0.0",
"model_class": LSTMModel,
"feature_config": feature_config | {"ignored_features":
[
"fertility_probability",
"ov_over_probability",
# "days_relative_to_ov",
# "is_biphasic",
"ov_day",
]},
"preprocessing": {
"window_shift": int((288 // take_every_nth) / 24 * shift_in_hours),
"take_every_nth": take_every_nth,
"min_input_length_fraction_for_padding": ((288 // take_every_nth) * 4) / input_window_length,
},
"batch_fn": produce_window_batches,
"collate_fn": simple_x_y_collate,
"model_creation_fn": simple_model_creation,
"model_save_fn": simple_model_save,
"model_load_fn": partial(simple_model_load, model_creation_fn=simple_model_creation),
"batch_loss_fn": get_model_loss,
"actual_fn": simple_get_y,
"predict_fn": simple_x_y_predict,
"model_parameters": {
**model_parameters,
},
"input_window_length": input_window_length,
"output_window_length": output_window_length,
"output_window_offset": output_window_offset,
}
base_training_config = {
"batch_size": batch_size,
"model_class": LSTMModel,
"learning_parameters": {
"learning_rate": max_lr * (batch_size / 4),
# "learning_rate": base_lr * (batch_size / 4),
"epochs": num_epochs,
"patience": patience,
},
"loss_functions": [
nn.MSELoss(),
nn.BCEWithLogitsLoss(),
],
"max_grad_norm": 1.0,
"train_size": 0.7,
"val_size": 0.15,
"test_size": 0.15,
}
return {
"name": run_name,
"description": run_description,
"model_configuration": base_model_config,
"training_configuration": base_training_config,
}
run_configuration = {
"item_limit": 100,
"runs": [
get_lstm_run_config(
run_name="lstm_regressor",
run_description="LSTM regressor for fertility prediction",
input_window_length=input_window_length,
output_window_length=output_window_length,
take_every_nth=take_every_nth,
shift_in_hours=shift_in_hours,
output_window_offset=output_window_offset,
batch_size=batch_size,
model_parameters={
"cnn_channels": 64,
"cnn_kernel_size": 3,
"embed_dim": 128,
"lstm_hidden_size": 128,
"num_layers": 4,
},
max_lr=max_lr,
num_epochs=1000,
patience=50,
feature_config=feature_config
)
]
}
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from functools import partial
from configs.feature_config import feature_config
from utils.data_utils import *
from utils.training import *
from models.third_party.patch_tst.models.PatchTST import Model as PatchTST
from models.utils import *
from models.collation import *
take_every_nth = int(288 / 12)
shift_in_hours = 12
input_window_length = (288 // take_every_nth) * 80
# output_window_length = (288 // take_every_nth) * 1
output_window_length = 1
output_window_offset = input_window_length + (288 // take_every_nth) * 0
window_shift = int((288 // take_every_nth) / 24 * shift_in_hours)
min_input_length_fraction_for_padding = ((288 // take_every_nth) * 4) / input_window_length
max_lr = 1e-5
batch_size = 64
run_configuration = {
"item_limit": 100,
"runs": [
{
"name": "lstm_ovulation_regression",
"description": "LSTM model for ovulation regression",
"model_configuration": {
"model_name": "patch_tst_regressor",
"version": "1.0.0",
"model_class": PatchTST,
"feature_config": feature_config | {"ignored_features":
[
"fertility_probability",
"ov_over_probability",
# "days_relative_to_ov",
# "is_biphasic",
"ov_day",
]},
"preprocessing": {
"window_shift": int((288 // take_every_nth) / 24 * shift_in_hours),
"take_every_nth": take_every_nth,
"min_input_length_fraction_for_padding": ((288 // take_every_nth) * 4) / input_window_length,
},
"batch_fn": produce_window_batches,
"collate_fn": simple_x_y_collate,
"model_creation_fn": simple_model_creation,
"model_save_fn": simple_model_save,
"model_load_fn": partial(simple_model_load, model_creation_fn=simple_model_creation),
"batch_loss_fn": get_model_loss,
"actual_fn": simple_get_y,
"predict_fn": simple_x_y_predict,
"model_parameters": {
"configs": {
# core
"seq_len": input_window_length,
"pred_len": output_window_length,
"seq_pred": False,
# model
"e_layers": 4,
"n_heads": 4,
"d_model": 128,
"d_ff": 128,
"dropout": 0.2,
"fc_dropout": 0.2,
"head_dropout": 0.0,
"individual": True,
# patch
# "patch_len": input_window_length,
"patch_len": int(288 / take_every_nth),
"stride": int(288 / take_every_nth / 2),
"padding_patch": 0,
# preprocessing
"revin": False,
"affine": False,
"subtract_last": False,
# decomp
"decomposition": True,
"kernel_size": 3,
}
},
"input_window_length": input_window_length,
"output_window_length": output_window_length,
"output_window_offset": output_window_offset,
},
"training_configuration": {
"batch_size": batch_size,
"model_class": PatchTST,
"learning_parameters": {
# "learning_rate": base_lr,
"learning_rate": max_lr * (batch_size / 4),
"epochs": 10,
"patience": 3,
},
"loss_functions": [
nn.MSELoss(),
nn.BCEWithLogitsLoss(),
],
"max_grad_norm": 1.0,
"train_size": 0.7,
"val_size": 0.15,
"test_size": 0.15,
}
}
]
}
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from functools import partial
from configs.feature_config import feature_config
from utils.data_utils import *
from utils.training import *
from models.transformer import *
from models.utils import *
from models.collation import *
take_every_nth = int(288 / 12)
shift_in_hours = 12
input_window_length = (288 // take_every_nth) * 80
# output_window_length = (288 // take_every_nth) * 1
output_window_length = 1
output_window_offset = input_window_length + (288 // take_every_nth) * 0
window_shift = int((288 // take_every_nth) / 24 * shift_in_hours)
min_input_length_fraction_for_padding = ((288 // take_every_nth) * 4) / input_window_length
transformer_batch_size = 128
def get_transformer_run_config(
run_name: str,
run_description: str,
input_window_length: int,
output_window_length: int,
take_every_nth: int,
shift_in_hours: int,
output_window_offset: int,
batch_size: int,
model_parameters: dict,
max_lr: float,
num_epochs: int,
patience: int,
feature_config: dict):
"""
Get the configuration for the Transformer model
Returns:
run_configuration: configuration for the Transformer model
"""
base_model_config = {
"model_name": "transformer_regressor",
"version": "1.0.0",
"model_class": TransformerModel,
"feature_config": feature_config | {"ignored_features":
[
"fertility_probability",
"ov_over_probability",
# "days_relative_to_ov",
# "is_biphasic",
"ov_day",
]},
"preprocessing": {
"window_shift": int((288 // take_every_nth) / 24 * shift_in_hours),
"take_every_nth": take_every_nth,
"min_input_length_fraction_for_padding": min_input_length_fraction_for_padding,
},
"batch_fn": produce_window_batches,
"model_creation_fn": simple_model_creation,
"collate_fn": simple_x_y_collate,
"model_save_fn": simple_model_save,
"model_load_fn": partial(simple_model_load, model_creation_fn=simple_model_creation),
"batch_loss_fn": get_model_loss,
"actual_fn": simple_get_y,
"predict_fn": simple_x_y_predict,
"model_parameters": {
**model_parameters | {"seq_len": input_window_length},
},
"input_window_length": input_window_length,
"output_window_length": output_window_length,
"output_window_offset": output_window_offset,
}
base_training_config = {
"batch_size": batch_size,
"model_class": TransformerModel,
"learning_parameters": {
"learning_rate": max_lr * (batch_size / 4),
# "learning_rate": base_lr * (batch_size / 4),
"epochs": num_epochs,
"patience": patience,
},
"loss_functions": [
nn.MSELoss(),
nn.BCEWithLogitsLoss(),
],
"max_grad_norm": 1.0,
"train_size": 0.7,
"val_size": 0.15,
"test_size": 0.15,
}
return {
"name": run_name,
"description": run_description,
"model_configuration": base_model_config,
"training_configuration": base_training_config
}
run_configuration = {
"runs": [
get_transformer_run_config(
run_name="transformer_ovulation_regression",
run_description="Transformer regressor for ovulation prediction",
input_window_length=input_window_length,
output_window_length=output_window_length,
take_every_nth=take_every_nth,
shift_in_hours=shift_in_hours,
output_window_offset=output_window_offset,
batch_size=transformer_batch_size,
model_parameters={
"embed_dim": 128,
"num_heads": 4,
"num_enc_layers": 4,
},
max_lr=1e-5,
num_epochs=20,
patience=3,
feature_config=feature_config,
)
]
}
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import sys
import argparse
from concurrent.futures import ProcessPoolExecutor
from functools import partial
import logging
import lmdb
import dotenv
from tqdm import tqdm
dotenv.load_dotenv()
from vsm_datascience_common.cycle_database_connection.cycle_data import get_cycle_by_id
from vsm_datascience_common.cycle_database_connection.db_utils import get_cycles_collection
from utils.dataset_creation import get_features, train_scalers, save_scalers, scale_item
from utils.lmdb_utils import save_to_lmdb, load_from_lmdb
from utils.utils import get_variable_from_module
MAX_LMDB_SIZE_IN_MB = 200_000
logger = logging.getLogger(__name__)
logger.setLevel(logging.INFO)
logger.addHandler(logging.StreamHandler(sys.stdout))
def process_id_wrapper(cycle_id: str, feature_config: dict, env: lmdb.Environment):
try:
cycle = get_cycle_by_id(cycle_id)
features = get_features(cycle, feature_config)
save_to_lmdb(env, key=str(cycle_id), dataset=features)
except:
pass
def scaling_wrapper(key_batch: str,
scalers: dict,
max_lmdb_size_in_mb: int,
lmdb_env_dir: str):
env = lmdb.open(lmdb_env_dir, readonly=True, lock=False)
scaled_items = list()
for key in key_batch:
item = load_from_lmdb(env, key)
scaled_item = scale_item(item, scalers)
scaled_items.append(scaled_item)
env.close()
env = lmdb.open(lmdb_env_dir, map_size=max_lmdb_size_in_mb * 1024 * 1024)
for key, scaled_item in zip(key_batch, scaled_items):
save_to_lmdb(env, key=key, dataset=scaled_item)
env.close()
def create_dataset(model_configuration: dict,
lmdb_root_dir: str,
max_lmdb_size_in_mb: int,
max_workers: int) -> None:
feature_config = model_configuration["feature_config"]
logger.info(f"Creating dataset for feature set {feature_config['feature_set_name']}")
# fetch valid cycle ids from database
valid_cycle_ids = [x["_id"] for x in get_cycles_collection().aggregate(
feature_config["filter_criteria_pipeline"] + [
{
"$project": {
"_id": 1
}
}
]
)]
logger.info(f"Fetched {len(valid_cycle_ids)} valid cycle ids from database")
env = lmdb.open(f"{lmdb_root_dir}/{feature_config['feature_set_name']}", map_size=max_lmdb_size_in_mb * 1024 * 1024)
# create features for items
logger.info(f"Creating features for {len(valid_cycle_ids)} cycles")
with ProcessPoolExecutor(max_workers=max_workers) as executor:
list(tqdm(executor.map(partial(process_id_wrapper, feature_config=feature_config, env=env), valid_cycle_ids),
total=len(valid_cycle_ids)))
# convert ids (here bson objectids) to keys for use in lmdb
keys = [str(cycle_id) for cycle_id in valid_cycle_ids]
# train scalers for featues
logger.info("Training scalers for features")
all_scalers = dict()
sample = load_from_lmdb(env, keys[0])
for feature_set in tqdm(feature_config["feature_sets"]):
for feature in feature_config[feature_set]:
print(f"Training scalers for feature {feature['name']} in feature set {feature_set}")
scaler = train_scalers(feature_set, feature["name"], feature["scaler"], sample, env)
if feature_set not in all_scalers:
all_scalers[feature_set] = dict()
all_scalers[feature_set] = all_scalers[feature_set] | scaler
# save scalers
logger.info("Saving scalers to disk")
scaler_dir = f"{lmdb_root_dir}/{feature_config['feature_set_name']}/scalers"
save_scalers(all_scalers, scaler_dir)
# creat scaling batches for less burden on lmdb
batch_size = 1_000
key_batches = [keys[i:i + batch_size] for i in range(0, len(keys), batch_size)]
# scale items
logger.info("Scaling items")
with ProcessPoolExecutor(max_workers=max_workers) as executor:
list(tqdm(executor.map(partial(scaling_wrapper, scalers=all_scalers,
max_lmdb_size_in_mb=max_lmdb_size_in_mb,
lmdb_env_dir=f"{lmdb_root_dir}/{feature_config['feature_set_name']}"),
key_batches),
total=len(key_batches)))
logger.info(f"Dataset creation finished. LMDB saved in {lmdb_root_dir}/{feature_config['feature_set_name']}")
if __name__ == "__main__":
parser = argparse.ArgumentParser(description="Dataset Creation Wrapper")
parser.add_argument("--model_config_module",
type=str,
required=True,
help="Path to the model config module")
parser.add_argument("--model_config_variable",
type=str,
required=False,
default="model_configuration",
help="Name of the model config variable, default is 'model_configuration'")
parser.add_argument("--lmdb_dir",
type=str,
required=False,
default="./lmdb_datasets",
help="Path to the lmdb directory")
parser.add_argument("--lmdb_size",
type=int,
required=False,
default=MAX_LMDB_SIZE_IN_MB,
help="Size of the lmdb in MB, default is 200_000")
parser.add_argument("--max_workers",
type=int,
required=False,
default=None,
help="Number of workers for multiprocessing, default is None (use all available cores)")
args = parser.parse_args()
# import and load the model config
model_configuration = get_variable_from_module(
module_path=args.model_config_module,
variable_name=args.model_config_variable
)
create_dataset(model_configuration,
lmdb_root_dir=args.lmdb_dir,
max_lmdb_size_in_mb=args.lmdb_size,
max_workers=args.max_workers)
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from functools import partial
import numpy as np
import sklearn
from utils.evaluation import *
def get_eval_functions(model_configuration: dict):
"""
Returns the evaluation functions for the model
:return: list of evaluation functions
"""
eval_functions = [
{
"name": "mean_absolute_error_overall",
"input_index": 0,
"eval_fn": sklearn.metrics.mean_absolute_error,
"accumulation_fn": np.mean,
},
{
"name": "mean_absolute_error_pre_ov",
"input_index": 0,
"eval_fn": pre_ov_error,
"accumulation_fn": np.mean,
},
{
"name": "mean_absolute_error_after_ov",
"input_index": 0,
"eval_fn": after_ov_error,
"accumulation_fn": np.mean,
},
{
"name": "mean_absolute_error_ov_in_days",
"input_index": 0,
"eval_fn": partial(ov_error, model_configuration=model_configuration),
"accumulation_fn": np.mean,
},
{
"name": "mean_absolute_error_five_days_before_ov",
"input_index": 0,
"eval_fn": partial(day_relative_to_ov_error,
day_relative_to_ov=-5,
model_configuration=model_configuration),
"accumulation_fn": np.mean,
}
]
return eval_functions
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import math
import torch
from torch import nn
class CNNTransformer(nn.Module):
def __init__(self,
input_dim,
output_dim,
seq_len,
cnn_channels,
kernel_size,
embed_dim,
num_enc_layers,
num_heads):
super().__init__()
self.cnn = nn.Sequential(
nn.Conv1d(input_dim, cnn_channels, kernel_size=kernel_size, padding=1),
nn.BatchNorm1d(cnn_channels),
nn.ReLU(),
nn.Conv1d(cnn_channels, embed_dim, kernel_size=kernel_size, padding=1),
nn.BatchNorm1d(embed_dim),
nn.ReLU()
)
# Compute positional embedding ONCE at init
pe = self._get_sinusoidal_embedding(seq_len, embed_dim) # (seq_len, embed_dim)
self.register_buffer('pos_embed', pe.unsqueeze(0)) # (1, seq_len, embed_dim)
encoder_layer = nn.TransformerEncoderLayer(embed_dim, num_heads)
self.encoder = nn.TransformerEncoder(encoder_layer, num_enc_layers)
self.pool = nn.AdaptiveAvgPool1d(1)
self.head = nn.Linear(embed_dim, output_dim)
def _get_sinusoidal_embedding(self, seq_len, embed_dim):
position = torch.arange(0, seq_len).unsqueeze(1)
div_term = torch.exp(torch.arange(0, embed_dim, 2) * -(math.log(10000.0) / embed_dim))
pe = torch.zeros(seq_len, embed_dim)
pe[:, 0::2] = torch.sin(position * div_term)
pe[:, 1::2] = torch.cos(position * div_term)
return pe # (seq_len, embed_dim)
def forward(self, x):
# x: (batch, seq_len, input_dim)
x = x.permute(0, 2, 1) # (B, input_dim, seq_len)
cnn_out = self.cnn(x) # (B, embed_dim, seq_len)
cnn_out = cnn_out.permute(2, 0, 1) # (S, B, E) for Transformer
# Add positional embedding
pos_embed = self.pos_embed[:, :cnn_out.size(0), :] # (1, seq_len, embed_dim)
pos_embed = pos_embed.transpose(0, 1) # → (seq_len, 1, embed_dim)
cnn_out = cnn_out + pos_embed # broadcast over batch
# Apply Transformer encoder
enc = self.encoder(cnn_out) # (S, B, E)
pooled = enc.mean(0) # (B, E)
return self.head(pooled)
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import numpy as np
import torch
def flat_x_y_collate(batch, *args, **kwargs) -> tuple:
"""
Collate function for a classical model with flat x and y feature vectors
"""
# Flatten each item in the batch
flattened_x = list()
flattened_y = list()
for i in range(len(batch)):
item = batch[i]
flattened_x_item = list()
flattened_y_item = list()
for j, (category, windows) in enumerate(item.items()):
for feature in windows.T:
if category == "target":
flattened_y_item.append(feature)
else:
flattened_x_item.append(feature)
# create numpy arrays with t_1_f1, t_1_f2, t_2_f1, t_2_f2 and so on
reordered_x = np.empty((len(flattened_x_item) * len(flattened_x_item[0])))
reordered_y = np.empty((len(flattened_y_item) * len(flattened_y_item[0])))
for j in range(len(flattened_x_item)):
for k in range(len(flattened_x_item[j])):
reordered_x[j + k * len(flattened_x_item)] = flattened_x_item[j][k]
for j in range(len(flattened_y_item)):
for k in range(len(flattened_y_item[j])):
reordered_y[j + k * len(flattened_y_item)] = flattened_y_item[j][k]
# append to the list
flattened_x.append(reordered_x)
flattened_y.append(reordered_y)
return np.array(flattened_x), np.array(flattened_y)
def simple_x_y_collate(batch):
"""
Collate function for LSTM model
"""
collated_x = list()
collated_y = list()
for item in batch:
current_x = list()
current_y = list()
for category, windows in item.items():
if category == "target_features":
current_y.append(windows)
else:
current_x.append(windows)
collated_x.append(np.concatenate(current_x, axis=1))
collated_y.append(np.concatenate(current_y, axis=1))
return torch.tensor(collated_x, dtype=torch.float32), torch.tensor(collated_y, dtype=torch.float32)
def collate_with_padding(batch,
padding_value: float = 0.0, ):
"""
Collate the batch with padding
"""
# create simple lists for x and y
collated_x = list()
collated_y = list()
for item in batch:
current_x = list()
current_y = list()
for category, windows in item.items():
if category == "target_features":
current_y.append(windows)
else:
current_x.append(windows)
collated_x.append(np.concatenate(current_x, axis=1))
collated_y.append(np.concatenate(current_y, axis=1))
# get the max length of the x and y
max_x_length = max([x.shape[0] for x in collated_x])
max_y_length = max([y.shape[0] for y in collated_y])
# pad the x and y
padded_x = list()
padded_y = list()
for x, y in zip(collated_x, collated_y):
padded_x.append(
np.pad(x, ((max_x_length - x.shape[0], 0), (0, 0)), mode='constant', constant_values=padding_value))
padded_y.append(
np.pad(y, ((max_y_length - y.shape[0], 0), (0, 0)), mode='constant', constant_values=padding_value))
return torch.tensor(padded_x, dtype=torch.float32), torch.tensor(padded_y, dtype=torch.float32)
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from torch import nn
class LSTMModel(nn.Module):
def __init__(self,
input_dim: int,
output_dim: int,
cnn_channels: int,
cnn_kernel_size: int,
embed_dim: int,
lstm_hidden_size=64,
num_layers=1):
super().__init__()
self.cnn = nn.Sequential(
nn.Conv1d(input_dim, cnn_channels, kernel_size=cnn_kernel_size, padding=1),
nn.BatchNorm1d(cnn_channels),
nn.ReLU(),
nn.Conv1d(cnn_channels, embed_dim, kernel_size=cnn_kernel_size, padding=1),
nn.BatchNorm1d(embed_dim),
nn.ReLU()
)
self.lstm = nn.LSTM(
input_size=embed_dim,
hidden_size=lstm_hidden_size,
num_layers=num_layers,
batch_first=True,
)
self.head = nn.Sequential(
nn.Linear(lstm_hidden_size, output_dim) # Output is a scalar Δt
)
def forward(self, x):
# x: (batch_size, seq_len, input_size)
x = x.permute(0, 2, 1)
# x: (batch_size, input_size, seq_len)
x = self.cnn(x)
# x: (batch_size, embed_dim, seq_len)
x = x.permute(0, 2, 1)
# x: (batch_size, seq_len, embed_dim)
x, _ = self.lstm(x)
# x: (batch_size, seq_len, lstm_hidden_size)
x = x[:, -1, :] # Get the last time step
# x: (batch_size, lstm_hidden_size)
x = self.head(x)
# x: (batch_size, output_size)
return x
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import datetime
import os
import torch
from torch import nn
from torch.optim import AdamW
from torch.optim.lr_scheduler import OneCycleLR
from torch.utils.data import IterableDataset, DataLoader
from models.third_party.tft_model import TemporalFusionTransformer
def get_tft_model(model_configuration: dict,
sample_item: dict,
device: str) -> nn.Module:
config_class = create_config_class(model_configuration, sample_item)
model = TemporalFusionTransformer(config_class)
model.to(device)
return model
def create_training_state(model_configuration: dict,
training_configuration: dict,
train_dataset: IterableDataset | DataLoader,
device: str) -> dict:
training_state = dict()
sample_item = next(iter(train_dataset))
if model_configuration["model_type"] == "TemporalFusionTransformer":
training_state["model"] = get_tft_model(model_configuration,
sample_item,
device)
else:
raise NotImplementedError(f"Model type {model_configuration['type']} not implemented")
training_state["optimizer"] = AdamW(training_state["model"].parameters(),
lr=training_configuration["learning_rate"])
training_state["scheduler"] = OneCycleLR(training_state["optimizer"],
max_lr=training_configuration["learning_rate"],
total_steps=len(train_dataset) *
training_configuration[
"epochs"])
training_state["current_epoch"] = 1
return training_state
def get_checkpoints(model_configuration: dict, training_configuration: dict) -> list:
checkpoints_dir = f"{model_configuration['model_dir']}/trainings/{training_configuration['id']}/checkpoints"
if os.path.exists(checkpoints_dir):
checkpoints = [os.path.join(checkpoints_dir, f) for f in os.listdir(checkpoints_dir) if
f.endswith('.pt') and "checkpoint" in f]
checkpoints.sort(key=os.path.getmtime, reverse=False)
return checkpoints
else:
return []
def load_checkpoint(checkpoint_path: str,
training_configuration: dict,
model_configuration: dict,
test_data_loader: IterableDataset | DataLoader,
device: str) -> tuple:
checkpoint = torch.load(checkpoint_path)
training_state = torch.load(checkpoint_path)
sample_item = next(iter(test_data_loader))
# load model
if model_configuration["model_type"] == "TemporalFusionTransformer":
model = get_tft_model(model_configuration,
sample_item,
device)
model_configuration["model"] = model
else:
raise NotImplementedError(f"Model type {model_configuration['model_type']} not implemented")
# load optimizer
optimizer = AdamW(model.parameters(), lr=training_configuration["learning_rate"])
optimizer.load_state_dict(checkpoint["optimizer"])
training_state["optimizer"] = optimizer
# load scheduler
scheduler = OneCycleLR(optimizer,
max_lr=training_configuration["learning_rate"],
total_steps=len(test_data_loader) * training_configuration["epochs"])
scheduler.load_state_dict(checkpoint["scheduler"])
training_state["scheduler"] = scheduler
return training_state
def save_checkpoint(training_config: dict,
training_state: dict,
model_config: dict) -> None:
checkpoints_dir = f"{model_config['model_dir']}/trainings/{training_config['id']}/checkpoints"
checkpoint_id = datetime.datetime.now().strftime("%Y%m%d_%H%M%S")
checkpoint_path = os.path.join(checkpoints_dir, f"checkpoint_{checkpoint_id}.pt")
if not os.path.exists(checkpoints_dir):
os.makedirs(checkpoints_dir)
config_to_save = training_state.copy()
# replace training parts with their state dicts
config_to_save["model"] = config_to_save["model"].state_dict()
config_to_save["optimizer"] = config_to_save["optimizer"].state_dict()
config_to_save["scheduler"] = config_to_save["scheduler"].state_dict()
# save training state
torch.save(config_to_save, checkpoint_path)
def create_config_class(config: dict, sample_batch: dict) -> object:
class ConfigClass:
def __init__(self):
# Feature sizes
self.static_categorical_inp_lens = []
self.temporal_known_categorical_inp_lens = []
self.temporal_observed_categorical_inp_lens = []
model_parameters = config["model_parameters"]
self.example_length = model_parameters["encoder_length"] + model_parameters["decoder_length"]
self.encoder_length = model_parameters["encoder_length"]
self.n_head = model_parameters["attention_heads"]
self.hidden_size = model_parameters["state_size"]
self.dropout = model_parameters["dropout"]
self.attn_dropout = model_parameters["attention_dropout"]
self.quantiles = model_parameters["output_quantiles"]
self.use_past_targets = model_parameters["use_past_targets"]
#### Derived variables ####
self.temporal_known_continuous_inp_size = sample_batch["k_cont"].shape[2]
self.temporal_observed_continuous_inp_size = sample_batch["o_cont"].shape[2]
self.temporal_target_size = sample_batch["target"].shape[2]
self.static_continuous_inp_size = sample_batch["s_cont"].shape[2]
self.num_static_vars = self.static_continuous_inp_size + len(self.static_categorical_inp_lens)
self.num_future_vars = self.temporal_known_continuous_inp_size + len(
self.temporal_known_categorical_inp_lens)
if self.use_past_targets:
self.num_historic_vars = self.num_future_vars + self.temporal_observed_continuous_inp_size + self.temporal_target_size + len(
self.temporal_observed_categorical_inp_lens)
else:
self.num_historic_vars = self.num_future_vars + self.temporal_observed_continuous_inp_size + len(
self.temporal_observed_categorical_inp_lens)
# self.num_historic_vars = sum([self.num_future_vars,
# self.temporal_observed_continuous_inp_size,
# self.temporal_target_size,
# len(self.temporal_observed_categorical_inp_lens),
# ])
self.target_size = self.temporal_target_size
return ConfigClass()
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import torch
import torch.nn as nn
import torch.nn.functional as F
import matplotlib.pyplot as plt
import numpy as np
import math
from math import sqrt
import os
class AutoCorrelation(nn.Module):
"""
AutoCorrelation Mechanism with the following two phases:
(1) period-based dependencies discovery
(2) time delay aggregation
This block can replace the self-attention family mechanism seamlessly.
"""
def __init__(self, mask_flag=True, factor=1, scale=None, attention_dropout=0.1, output_attention=False):
super(AutoCorrelation, self).__init__()
self.factor = factor
self.scale = scale
self.mask_flag = mask_flag
self.output_attention = output_attention
self.dropout = nn.Dropout(attention_dropout)
def time_delay_agg_training(self, values, corr):
"""
SpeedUp version of Autocorrelation (a batch-normalization style design)
This is for the training phase.
"""
head = values.shape[1]
channel = values.shape[2]
length = values.shape[3]
# find top k
top_k = int(self.factor * math.log(length))
mean_value = torch.mean(torch.mean(corr, dim=1), dim=1)
index = torch.topk(torch.mean(mean_value, dim=0), top_k, dim=-1)[1]
weights = torch.stack([mean_value[:, index[i]] for i in range(top_k)], dim=-1)
# update corr
tmp_corr = torch.softmax(weights, dim=-1)
# aggregation
tmp_values = values
delays_agg = torch.zeros_like(values).float()
for i in range(top_k):
pattern = torch.roll(tmp_values, -int(index[i]), -1)
delays_agg = delays_agg + pattern * \
(tmp_corr[:, i].unsqueeze(1).unsqueeze(1).unsqueeze(1).repeat(1, head, channel, length))
return delays_agg
def time_delay_agg_inference(self, values, corr):
"""
SpeedUp version of Autocorrelation (a batch-normalization style design)
This is for the inference phase.
"""
batch = values.shape[0]
head = values.shape[1]
channel = values.shape[2]
length = values.shape[3]
# index init
init_index = torch.arange(length).unsqueeze(0).unsqueeze(0).unsqueeze(0).repeat(batch, head, channel, 1).cuda()
# find top k
top_k = int(self.factor * math.log(length))
mean_value = torch.mean(torch.mean(corr, dim=1), dim=1)
weights = torch.topk(mean_value, top_k, dim=-1)[0]
delay = torch.topk(mean_value, top_k, dim=-1)[1]
# update corr
tmp_corr = torch.softmax(weights, dim=-1)
# aggregation
tmp_values = values.repeat(1, 1, 1, 2)
delays_agg = torch.zeros_like(values).float()
for i in range(top_k):
tmp_delay = init_index + delay[:, i].unsqueeze(1).unsqueeze(1).unsqueeze(1).repeat(1, head, channel, length)
pattern = torch.gather(tmp_values, dim=-1, index=tmp_delay)
delays_agg = delays_agg + pattern * \
(tmp_corr[:, i].unsqueeze(1).unsqueeze(1).unsqueeze(1).repeat(1, head, channel, length))
return delays_agg
def time_delay_agg_full(self, values, corr):
"""
Standard version of Autocorrelation
"""
batch = values.shape[0]
head = values.shape[1]
channel = values.shape[2]
length = values.shape[3]
# index init
init_index = torch.arange(length).unsqueeze(0).unsqueeze(0).unsqueeze(0).repeat(batch, head, channel, 1).cuda()
# find top k
top_k = int(self.factor * math.log(length))
weights = torch.topk(corr, top_k, dim=-1)[0]
delay = torch.topk(corr, top_k, dim=-1)[1]
# update corr
tmp_corr = torch.softmax(weights, dim=-1)
# aggregation
tmp_values = values.repeat(1, 1, 1, 2)
delays_agg = torch.zeros_like(values).float()
for i in range(top_k):
tmp_delay = init_index + delay[..., i].unsqueeze(-1)
pattern = torch.gather(tmp_values, dim=-1, index=tmp_delay)
delays_agg = delays_agg + pattern * (tmp_corr[..., i].unsqueeze(-1))
return delays_agg
def forward(self, queries, keys, values, attn_mask):
B, L, H, E = queries.shape
_, S, _, D = values.shape
if L > S:
zeros = torch.zeros_like(queries[:, :(L - S), :]).float()
values = torch.cat([values, zeros], dim=1)
keys = torch.cat([keys, zeros], dim=1)
else:
values = values[:, :L, :, :]
keys = keys[:, :L, :, :]
# period-based dependencies
q_fft = torch.fft.rfft(queries.permute(0, 2, 3, 1).contiguous(), dim=-1)
k_fft = torch.fft.rfft(keys.permute(0, 2, 3, 1).contiguous(), dim=-1)
res = q_fft * torch.conj(k_fft)
corr = torch.fft.irfft(res, dim=-1)
# time delay agg
if self.training:
V = self.time_delay_agg_training(values.permute(0, 2, 3, 1).contiguous(), corr).permute(0, 3, 1, 2)
else:
V = self.time_delay_agg_inference(values.permute(0, 2, 3, 1).contiguous(), corr).permute(0, 3, 1, 2)
if self.output_attention:
return (V.contiguous(), corr.permute(0, 3, 1, 2))
else:
return (V.contiguous(), None)
class AutoCorrelationLayer(nn.Module):
def __init__(self, correlation, d_model, n_heads, d_keys=None,
d_values=None):
super(AutoCorrelationLayer, self).__init__()
d_keys = d_keys or (d_model // n_heads)
d_values = d_values or (d_model // n_heads)
self.inner_correlation = correlation
self.query_projection = nn.Linear(d_model, d_keys * n_heads)
self.key_projection = nn.Linear(d_model, d_keys * n_heads)
self.value_projection = nn.Linear(d_model, d_values * n_heads)
self.out_projection = nn.Linear(d_values * n_heads, d_model)
self.n_heads = n_heads
def forward(self, queries, keys, values, attn_mask):
B, L, _ = queries.shape
_, S, _ = keys.shape
H = self.n_heads
queries = self.query_projection(queries).view(B, L, H, -1)
keys = self.key_projection(keys).view(B, S, H, -1)
values = self.value_projection(values).view(B, S, H, -1)
out, attn = self.inner_correlation(
queries,
keys,
values,
attn_mask
)
out = out.view(B, L, -1)
return self.out_projection(out), attn
@@ -0,0 +1,173 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
class my_Layernorm(nn.Module):
"""
Special designed layernorm for the seasonal part
"""
def __init__(self, channels):
super(my_Layernorm, self).__init__()
self.layernorm = nn.LayerNorm(channels)
def forward(self, x):
x_hat = self.layernorm(x)
bias = torch.mean(x_hat, dim=1).unsqueeze(1).repeat(1, x.shape[1], 1)
return x_hat - bias
class moving_avg(nn.Module):
"""
Moving average block to highlight the trend of time series
"""
def __init__(self, kernel_size, stride):
super(moving_avg, self).__init__()
self.kernel_size = kernel_size
self.avg = nn.AvgPool1d(kernel_size=kernel_size, stride=stride, padding=0)
def forward(self, x):
# padding on the both ends of time series
front = x[:, 0:1, :].repeat(1, (self.kernel_size - 1) // 2, 1)
end = x[:, -1:, :].repeat(1, (self.kernel_size - 1) // 2, 1)
x = torch.cat([front, x, end], dim=1)
x = self.avg(x.permute(0, 2, 1))
x = x.permute(0, 2, 1)
return x
class series_decomp(nn.Module):
"""
Series decomposition block
"""
def __init__(self, kernel_size):
super(series_decomp, self).__init__()
self.moving_avg = moving_avg(kernel_size, stride=1)
def forward(self, x):
moving_mean = self.moving_avg(x)
res = x - moving_mean
return res, moving_mean
class EncoderLayer(nn.Module):
"""
Autoformer encoder layer with the progressive decomposition architecture
"""
def __init__(self, attention, d_model, d_ff=None, moving_avg=25, dropout=0.1, activation="relu"):
super(EncoderLayer, self).__init__()
d_ff = d_ff or 4 * d_model
self.attention = attention
self.conv1 = nn.Conv1d(in_channels=d_model, out_channels=d_ff, kernel_size=1, bias=False)
self.conv2 = nn.Conv1d(in_channels=d_ff, out_channels=d_model, kernel_size=1, bias=False)
self.decomp1 = series_decomp(moving_avg)
self.decomp2 = series_decomp(moving_avg)
self.dropout = nn.Dropout(dropout)
self.activation = F.relu if activation == "relu" else F.gelu
def forward(self, x, attn_mask=None):
new_x, attn = self.attention(
x, x, x,
attn_mask=attn_mask
)
x = x + self.dropout(new_x)
x, _ = self.decomp1(x)
y = x
y = self.dropout(self.activation(self.conv1(y.transpose(-1, 1))))
y = self.dropout(self.conv2(y).transpose(-1, 1))
res, _ = self.decomp2(x + y)
return res, attn
class Encoder(nn.Module):
"""
Autoformer encoder
"""
def __init__(self, attn_layers, conv_layers=None, norm_layer=None):
super(Encoder, self).__init__()
self.attn_layers = nn.ModuleList(attn_layers)
self.conv_layers = nn.ModuleList(conv_layers) if conv_layers is not None else None
self.norm = norm_layer
def forward(self, x, attn_mask=None):
attns = []
if self.conv_layers is not None:
for attn_layer, conv_layer in zip(self.attn_layers, self.conv_layers):
x, attn = attn_layer(x, attn_mask=attn_mask)
x = conv_layer(x)
attns.append(attn)
x, attn = self.attn_layers[-1](x)
attns.append(attn)
else:
for attn_layer in self.attn_layers:
x, attn = attn_layer(x, attn_mask=attn_mask)
attns.append(attn)
if self.norm is not None:
x = self.norm(x)
return x, attns
class DecoderLayer(nn.Module):
"""
Autoformer decoder layer with the progressive decomposition architecture
"""
def __init__(self, self_attention, cross_attention, d_model, c_out, d_ff=None,
moving_avg=25, dropout=0.1, activation="relu"):
super(DecoderLayer, self).__init__()
d_ff = d_ff or 4 * d_model
self.self_attention = self_attention
self.cross_attention = cross_attention
self.conv1 = nn.Conv1d(in_channels=d_model, out_channels=d_ff, kernel_size=1, bias=False)
self.conv2 = nn.Conv1d(in_channels=d_ff, out_channels=d_model, kernel_size=1, bias=False)
self.decomp1 = series_decomp(moving_avg)
self.decomp2 = series_decomp(moving_avg)
self.decomp3 = series_decomp(moving_avg)
self.dropout = nn.Dropout(dropout)
self.projection = nn.Conv1d(in_channels=d_model, out_channels=c_out, kernel_size=3, stride=1, padding=1,
padding_mode='circular', bias=False)
self.activation = F.relu if activation == "relu" else F.gelu
def forward(self, x, cross, x_mask=None, cross_mask=None):
x = x + self.dropout(self.self_attention(
x, x, x,
attn_mask=x_mask
)[0])
x, trend1 = self.decomp1(x)
x = x + self.dropout(self.cross_attention(
x, cross, cross,
attn_mask=cross_mask
)[0])
x, trend2 = self.decomp2(x)
y = x
y = self.dropout(self.activation(self.conv1(y.transpose(-1, 1))))
y = self.dropout(self.conv2(y).transpose(-1, 1))
x, trend3 = self.decomp3(x + y)
residual_trend = trend1 + trend2 + trend3
residual_trend = self.projection(residual_trend.permute(0, 2, 1)).transpose(1, 2)
return x, residual_trend
class Decoder(nn.Module):
"""
Autoformer encoder
"""
def __init__(self, layers, norm_layer=None, projection=None):
super(Decoder, self).__init__()
self.layers = nn.ModuleList(layers)
self.norm = norm_layer
self.projection = projection
def forward(self, x, cross, x_mask=None, cross_mask=None, trend=None):
for layer in self.layers:
x, residual_trend = layer(x, cross, x_mask=x_mask, cross_mask=cross_mask)
trend = trend + residual_trend
if self.norm is not None:
x = self.norm(x)
if self.projection is not None:
x = self.projection(x)
return x, trend
@@ -0,0 +1,164 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
from torch.nn.utils import weight_norm
import math
class PositionalEmbedding(nn.Module):
def __init__(self, d_model, max_len=5000):
super(PositionalEmbedding, self).__init__()
# Compute the positional encodings once in log space.
pe = torch.zeros(max_len, d_model).float()
pe.require_grad = False
position = torch.arange(0, max_len).float().unsqueeze(1)
div_term = (torch.arange(0, d_model, 2).float() * -(math.log(10000.0) / d_model)).exp()
pe[:, 0::2] = torch.sin(position * div_term)
pe[:, 1::2] = torch.cos(position * div_term)
pe = pe.unsqueeze(0)
self.register_buffer('pe', pe)
def forward(self, x):
return self.pe[:, :x.size(1)]
class TokenEmbedding(nn.Module):
def __init__(self, c_in, d_model):
super(TokenEmbedding, self).__init__()
padding = 1 if torch.__version__ >= '1.5.0' else 2
self.tokenConv = nn.Conv1d(in_channels=c_in, out_channels=d_model,
kernel_size=3, padding=padding, padding_mode='circular', bias=False)
for m in self.modules():
if isinstance(m, nn.Conv1d):
nn.init.kaiming_normal_(m.weight, mode='fan_in', nonlinearity='leaky_relu')
def forward(self, x):
x = self.tokenConv(x.permute(0, 2, 1)).transpose(1, 2)
return x
class FixedEmbedding(nn.Module):
def __init__(self, c_in, d_model):
super(FixedEmbedding, self).__init__()
w = torch.zeros(c_in, d_model).float()
w.require_grad = False
position = torch.arange(0, c_in).float().unsqueeze(1)
div_term = (torch.arange(0, d_model, 2).float() * -(math.log(10000.0) / d_model)).exp()
w[:, 0::2] = torch.sin(position * div_term)
w[:, 1::2] = torch.cos(position * div_term)
self.emb = nn.Embedding(c_in, d_model)
self.emb.weight = nn.Parameter(w, requires_grad=False)
def forward(self, x):
return self.emb(x).detach()
class TemporalEmbedding(nn.Module):
def __init__(self, d_model, embed_type='fixed', freq='h'):
super(TemporalEmbedding, self).__init__()
minute_size = 4
hour_size = 24
weekday_size = 7
day_size = 32
month_size = 13
Embed = FixedEmbedding if embed_type == 'fixed' else nn.Embedding
if freq == 't':
self.minute_embed = Embed(minute_size, d_model)
self.hour_embed = Embed(hour_size, d_model)
self.weekday_embed = Embed(weekday_size, d_model)
self.day_embed = Embed(day_size, d_model)
self.month_embed = Embed(month_size, d_model)
def forward(self, x):
x = x.long()
minute_x = self.minute_embed(x[:, :, 4]) if hasattr(self, 'minute_embed') else 0.
hour_x = self.hour_embed(x[:, :, 3])
weekday_x = self.weekday_embed(x[:, :, 2])
day_x = self.day_embed(x[:, :, 1])
month_x = self.month_embed(x[:, :, 0])
return hour_x + weekday_x + day_x + month_x + minute_x
class TimeFeatureEmbedding(nn.Module):
def __init__(self, d_model, embed_type='timeF', freq='h'):
super(TimeFeatureEmbedding, self).__init__()
freq_map = {'h': 4, 't': 5, 's': 6, 'm': 1, 'a': 1, 'w': 2, 'd': 3, 'b': 3}
d_inp = freq_map[freq]
self.embed = nn.Linear(d_inp, d_model, bias=False)
def forward(self, x):
return self.embed(x)
class DataEmbedding(nn.Module):
def __init__(self, c_in, d_model, embed_type='fixed', freq='h', dropout=0.1):
super(DataEmbedding, self).__init__()
self.value_embedding = TokenEmbedding(c_in=c_in, d_model=d_model)
self.position_embedding = PositionalEmbedding(d_model=d_model)
self.temporal_embedding = TemporalEmbedding(d_model=d_model, embed_type=embed_type,
freq=freq) if embed_type != 'timeF' else TimeFeatureEmbedding(
d_model=d_model, embed_type=embed_type, freq=freq)
self.dropout = nn.Dropout(p=dropout)
def forward(self, x, x_mark):
x = self.value_embedding(x) + self.temporal_embedding(x_mark) + self.position_embedding(x)
return self.dropout(x)
class DataEmbedding_wo_pos(nn.Module):
def __init__(self, c_in, d_model, embed_type='fixed', freq='h', dropout=0.1):
super(DataEmbedding_wo_pos, self).__init__()
self.value_embedding = TokenEmbedding(c_in=c_in, d_model=d_model)
self.position_embedding = PositionalEmbedding(d_model=d_model)
self.temporal_embedding = TemporalEmbedding(d_model=d_model, embed_type=embed_type,
freq=freq) if embed_type != 'timeF' else TimeFeatureEmbedding(
d_model=d_model, embed_type=embed_type, freq=freq)
self.dropout = nn.Dropout(p=dropout)
def forward(self, x, x_mark):
x = self.value_embedding(x) + self.temporal_embedding(x_mark)
return self.dropout(x)
class DataEmbedding_wo_pos_temp(nn.Module):
def __init__(self, c_in, d_model, embed_type='fixed', freq='h', dropout=0.1):
super(DataEmbedding_wo_pos_temp, self).__init__()
self.value_embedding = TokenEmbedding(c_in=c_in, d_model=d_model)
self.position_embedding = PositionalEmbedding(d_model=d_model)
self.temporal_embedding = TemporalEmbedding(d_model=d_model, embed_type=embed_type,
freq=freq) if embed_type != 'timeF' else TimeFeatureEmbedding(
d_model=d_model, embed_type=embed_type, freq=freq)
self.dropout = nn.Dropout(p=dropout)
def forward(self, x, x_mark):
x = self.value_embedding(x)
return self.dropout(x)
class DataEmbedding_wo_temp(nn.Module):
def __init__(self, c_in, d_model, embed_type='fixed', freq='h', dropout=0.1):
super(DataEmbedding_wo_temp, self).__init__()
self.value_embedding = TokenEmbedding(c_in=c_in, d_model=d_model)
self.position_embedding = PositionalEmbedding(d_model=d_model)
self.temporal_embedding = TemporalEmbedding(d_model=d_model, embed_type=embed_type,
freq=freq) if embed_type != 'timeF' else TimeFeatureEmbedding(
d_model=d_model, embed_type=embed_type, freq=freq)
self.dropout = nn.Dropout(p=dropout)
def forward(self, x, x_mark):
x = self.value_embedding(x) + self.position_embedding(x)
return self.dropout(x)
@@ -0,0 +1,429 @@
__all__ = ['PatchTST_backbone']
# Cell
from typing import Callable, Optional
import torch
from torch import nn
from torch import Tensor
import torch.nn.functional as F
import numpy as np
# from collections import OrderedDict
from models.third_party.patch_tst.layers.PatchTST_layers import *
from models.third_party.patch_tst.layers.RevIN import RevIN
class CustomHead(nn.Module):
def __init__(self, output_dim, n_vars, target_window, nf, head_dropout=0):
super().__init__()
self.flatten = nn.Flatten(start_dim=-3)
self.linear = nn.Linear(nf * n_vars, output_dim * target_window)
self.dropout = nn.Dropout(head_dropout)
self.target_window = target_window
self.output_dim = output_dim
def forward(self, x): # x: [bs x nvars x d_model x patch_num]
x = self.flatten(x) # [bs x (nf * nvars)]
x = self.linear(x) # [bs x (target_window * output_dim)]
x = self.dropout(x)
x = x.view(x.size(0), self.target_window, self.output_dim) # [bs x target_window x output_dim]
# permute to match intended structure
x = x.permute(0, 2, 1) # [bs x output_dim x target_window]
return x
# Cell
class PatchTST_backbone(nn.Module):
def __init__(self, c_in: int,
context_window: int, target_window: int, patch_len: int, stride: int,
# extras
dec_out: int = 1,
seq_pred: bool = False,
#
max_seq_len: Optional[int] = 1024,
n_layers: int = 3, d_model=128, n_heads=16, d_k: Optional[int] = None, d_v: Optional[int] = None,
d_ff: int = 256, norm: str = 'BatchNorm', attn_dropout: float = 0., dropout: float = 0.,
act: str = "gelu", key_padding_mask: bool = 'auto',
padding_var: Optional[int] = None, attn_mask: Optional[Tensor] = None, res_attention: bool = True,
pre_norm: bool = False, store_attn: bool = False,
pe: str = 'zeros', learn_pe: bool = True, fc_dropout: float = 0., head_dropout=0, padding_patch=None,
pretrain_head: bool = False, head_type='flatten', individual=False, revin=True, affine=True,
subtract_last=False,
verbose: bool = False, **kwargs):
super().__init__()
# RevIn
self.revin = revin
if self.revin: self.revin_layer = RevIN(c_in, affine=affine, subtract_last=subtract_last)
# Patching
self.patch_len = patch_len
self.stride = stride
self.padding_patch = padding_patch
patch_num = int((context_window - patch_len) / stride + 1)
if padding_patch == 'end': # can be modified to general case
self.padding_patch_layer = nn.ReplicationPad1d((0, stride))
patch_num += 1
# Backbone
self.backbone = TSTiEncoder(c_in, patch_num=patch_num, patch_len=patch_len, max_seq_len=max_seq_len,
n_layers=n_layers, d_model=d_model, n_heads=n_heads, d_k=d_k, d_v=d_v, d_ff=d_ff,
attn_dropout=attn_dropout, dropout=dropout, act=act,
key_padding_mask=key_padding_mask, padding_var=padding_var,
attn_mask=attn_mask, res_attention=res_attention, pre_norm=pre_norm,
store_attn=store_attn,
pe=pe, learn_pe=learn_pe, verbose=verbose, **kwargs)
# Head
self.head_nf = d_model * patch_num
self.n_vars = c_in
self.pretrain_head = pretrain_head
self.head_type = head_type
self.individual = individual
# extras for non-sequence prediction
self.seq_pred = seq_pred
self.dec_out = dec_out
if self.pretrain_head:
self.head = self.create_pretrain_head(self.head_nf, c_in,
fc_dropout) # custom head passed as a partial func with all its kwargs
elif not self.seq_pred:
self.head = CustomHead(output_dim=self.dec_out,
n_vars=self.n_vars,
target_window=target_window,
nf=self.head_nf,
head_dropout=head_dropout)
elif head_type == 'flatten':
self.head = Flatten_Head(self.individual, self.n_vars, self.head_nf, target_window,
head_dropout=head_dropout)
def forward(self, z): # z: [bs x nvars x seq_len]
# norm
if self.revin:
z = z.permute(0, 2, 1)
z = self.revin_layer(z, 'norm')
z = z.permute(0, 2, 1)
# do patching
if self.padding_patch == 'end':
z = self.padding_patch_layer(z)
z = z.unfold(dimension=-1, size=self.patch_len, step=self.stride) # z: [bs x nvars x patch_num x patch_len]
z = z.permute(0, 1, 3, 2) # z: [bs x nvars x patch_len x patch_num]
# model
z = self.backbone(z) # z: [bs x nvars x d_model x patch_num]
z = self.head(z) # z: [bs x nvars x target_window]
# denorm
if self.revin:
z = z.permute(0, 2, 1)
z = self.revin_layer(z, 'denorm')
z = z.permute(0, 2, 1)
return z
def create_pretrain_head(self, head_nf, vars, dropout):
return nn.Sequential(nn.Dropout(dropout),
nn.Conv1d(head_nf, vars, 1)
)
class Flatten_Head(nn.Module):
def __init__(self, individual, n_vars, nf, target_window, head_dropout=0):
super().__init__()
self.individual = individual
self.n_vars = n_vars
if self.individual:
self.linears = nn.ModuleList()
self.dropouts = nn.ModuleList()
self.flattens = nn.ModuleList()
for i in range(self.n_vars):
self.flattens.append(nn.Flatten(start_dim=-2))
self.linears.append(nn.Linear(nf, target_window))
self.dropouts.append(nn.Dropout(head_dropout))
else:
self.flatten = nn.Flatten(start_dim=-2)
self.linear = nn.Linear(nf, target_window)
self.dropout = nn.Dropout(head_dropout)
def forward(self, x): # x: [bs x nvars x d_model x patch_num]
if self.individual:
x_out = []
for i in range(self.n_vars):
z = self.flattens[i](x[:, i, :, :]) # z: [bs x d_model * patch_num]
z = self.linears[i](z) # z: [bs x target_window]
z = self.dropouts[i](z)
x_out.append(z)
x = torch.stack(x_out, dim=1) # x: [bs x nvars x target_window]
else:
x = self.flatten(x)
x = self.linear(x)
x = self.dropout(x)
return x
class TSTiEncoder(nn.Module): # i means channel-independent
def __init__(self, c_in, patch_num, patch_len, max_seq_len=1024,
n_layers=3, d_model=128, n_heads=16, d_k=None, d_v=None,
d_ff=256, norm='BatchNorm', attn_dropout=0., dropout=0., act="gelu", store_attn=False,
key_padding_mask='auto', padding_var=None, attn_mask=None, res_attention=True, pre_norm=False,
pe='zeros', learn_pe=True, verbose=False, **kwargs):
super().__init__()
self.patch_num = patch_num
self.patch_len = patch_len
# Input encoding
q_len = patch_num
self.W_P = nn.Linear(patch_len, d_model) # Eq 1: projection of feature vectors onto a d-dim vector space
self.seq_len = q_len
# Positional encoding
self.W_pos = positional_encoding(pe, learn_pe, q_len, d_model)
# Residual dropout
self.dropout = nn.Dropout(dropout)
# Encoder
self.encoder = TSTEncoder(q_len, d_model, n_heads, d_k=d_k, d_v=d_v, d_ff=d_ff, norm=norm,
attn_dropout=attn_dropout, dropout=dropout,
pre_norm=pre_norm, activation=act, res_attention=res_attention, n_layers=n_layers,
store_attn=store_attn)
def forward(self, x) -> Tensor: # x: [bs x nvars x patch_len x patch_num]
n_vars = x.shape[1]
# Input encoding
x = x.permute(0, 1, 3, 2) # x: [bs x nvars x patch_num x patch_len]
x = self.W_P(x) # x: [bs x nvars x patch_num x d_model]
u = torch.reshape(x, (x.shape[0] * x.shape[1], x.shape[2], x.shape[3])) # u: [bs * nvars x patch_num x d_model]
u = self.dropout(u + self.W_pos) # u: [bs * nvars x patch_num x d_model]
# Encoder
z = self.encoder(u) # z: [bs * nvars x patch_num x d_model]
z = torch.reshape(z, (-1, n_vars, z.shape[-2], z.shape[-1])) # z: [bs x nvars x patch_num x d_model]
z = z.permute(0, 1, 3, 2) # z: [bs x nvars x d_model x patch_num]
return z
# Cell
class TSTEncoder(nn.Module):
def __init__(self, q_len, d_model, n_heads, d_k=None, d_v=None, d_ff=None,
norm='BatchNorm', attn_dropout=0., dropout=0., activation='gelu',
res_attention=False, n_layers=1, pre_norm=False, store_attn=False):
super().__init__()
self.layers = nn.ModuleList(
[TSTEncoderLayer(q_len, d_model, n_heads=n_heads, d_k=d_k, d_v=d_v, d_ff=d_ff, norm=norm,
attn_dropout=attn_dropout, dropout=dropout,
activation=activation, res_attention=res_attention,
pre_norm=pre_norm, store_attn=store_attn) for i in range(n_layers)])
self.res_attention = res_attention
def forward(self, src: Tensor, key_padding_mask: Optional[Tensor] = None, attn_mask: Optional[Tensor] = None):
output = src
scores = None
if self.res_attention:
for mod in self.layers: output, scores = mod(output, prev=scores, key_padding_mask=key_padding_mask,
attn_mask=attn_mask)
return output
else:
for mod in self.layers: output = mod(output, key_padding_mask=key_padding_mask, attn_mask=attn_mask)
return output
class TSTEncoderLayer(nn.Module):
def __init__(self, q_len, d_model, n_heads, d_k=None, d_v=None, d_ff=256, store_attn=False,
norm='BatchNorm', attn_dropout=0, dropout=0., bias=True, activation="gelu", res_attention=False,
pre_norm=False):
super().__init__()
assert not d_model % n_heads, f"d_model ({d_model}) must be divisible by n_heads ({n_heads})"
d_k = d_model // n_heads if d_k is None else d_k
d_v = d_model // n_heads if d_v is None else d_v
# Multi-Head attention
self.res_attention = res_attention
self.self_attn = _MultiheadAttention(d_model, n_heads, d_k, d_v, attn_dropout=attn_dropout,
proj_dropout=dropout, res_attention=res_attention)
# Add & Norm
self.dropout_attn = nn.Dropout(dropout)
if "batch" in norm.lower():
self.norm_attn = nn.Sequential(Transpose(1, 2), nn.BatchNorm1d(d_model), Transpose(1, 2))
else:
self.norm_attn = nn.LayerNorm(d_model)
# Position-wise Feed-Forward
self.ff = nn.Sequential(nn.Linear(d_model, d_ff, bias=bias),
get_activation_fn(activation),
nn.Dropout(dropout),
nn.Linear(d_ff, d_model, bias=bias))
# Add & Norm
self.dropout_ffn = nn.Dropout(dropout)
if "batch" in norm.lower():
self.norm_ffn = nn.Sequential(Transpose(1, 2), nn.BatchNorm1d(d_model), Transpose(1, 2))
else:
self.norm_ffn = nn.LayerNorm(d_model)
self.pre_norm = pre_norm
self.store_attn = store_attn
def forward(self, src: Tensor, prev: Optional[Tensor] = None, key_padding_mask: Optional[Tensor] = None,
attn_mask: Optional[Tensor] = None) -> Tensor:
# Multi-Head attention sublayer
if self.pre_norm:
src = self.norm_attn(src)
## Multi-Head attention
if self.res_attention:
src2, attn, scores = self.self_attn(src, src, src, prev, key_padding_mask=key_padding_mask,
attn_mask=attn_mask)
else:
src2, attn = self.self_attn(src, src, src, key_padding_mask=key_padding_mask, attn_mask=attn_mask)
if self.store_attn:
self.attn = attn
## Add & Norm
src = src + self.dropout_attn(src2) # Add: residual connection with residual dropout
if not self.pre_norm:
src = self.norm_attn(src)
# Feed-forward sublayer
if self.pre_norm:
src = self.norm_ffn(src)
## Position-wise Feed-Forward
src2 = self.ff(src)
## Add & Norm
src = src + self.dropout_ffn(src2) # Add: residual connection with residual dropout
if not self.pre_norm:
src = self.norm_ffn(src)
if self.res_attention:
return src, scores
else:
return src
class _MultiheadAttention(nn.Module):
def __init__(self, d_model, n_heads, d_k=None, d_v=None, res_attention=False, attn_dropout=0., proj_dropout=0.,
qkv_bias=True, lsa=False):
"""Multi Head Attention Layer
Input shape:
Q: [batch_size (bs) x max_q_len x d_model]
K, V: [batch_size (bs) x q_len x d_model]
mask: [q_len x q_len]
"""
super().__init__()
d_k = d_model // n_heads if d_k is None else d_k
d_v = d_model // n_heads if d_v is None else d_v
self.n_heads, self.d_k, self.d_v = n_heads, d_k, d_v
self.W_Q = nn.Linear(d_model, d_k * n_heads, bias=qkv_bias)
self.W_K = nn.Linear(d_model, d_k * n_heads, bias=qkv_bias)
self.W_V = nn.Linear(d_model, d_v * n_heads, bias=qkv_bias)
# Scaled Dot-Product Attention (multiple heads)
self.res_attention = res_attention
self.sdp_attn = _ScaledDotProductAttention(d_model, n_heads, attn_dropout=attn_dropout,
res_attention=self.res_attention, lsa=lsa)
# Poject output
self.to_out = nn.Sequential(nn.Linear(n_heads * d_v, d_model), nn.Dropout(proj_dropout))
def forward(self, Q: Tensor, K: Optional[Tensor] = None, V: Optional[Tensor] = None, prev: Optional[Tensor] = None,
key_padding_mask: Optional[Tensor] = None, attn_mask: Optional[Tensor] = None):
bs = Q.size(0)
if K is None: K = Q
if V is None: V = Q
# Linear (+ split in multiple heads)
q_s = self.W_Q(Q).view(bs, -1, self.n_heads, self.d_k).transpose(1,
2) # q_s : [bs x n_heads x max_q_len x d_k]
k_s = self.W_K(K).view(bs, -1, self.n_heads, self.d_k).permute(0, 2, 3,
1) # k_s : [bs x n_heads x d_k x q_len] - transpose(1,2) + transpose(2,3)
v_s = self.W_V(V).view(bs, -1, self.n_heads, self.d_v).transpose(1, 2) # v_s : [bs x n_heads x q_len x d_v]
# Apply Scaled Dot-Product Attention (multiple heads)
if self.res_attention:
output, attn_weights, attn_scores = self.sdp_attn(q_s, k_s, v_s, prev=prev,
key_padding_mask=key_padding_mask, attn_mask=attn_mask)
else:
output, attn_weights = self.sdp_attn(q_s, k_s, v_s, key_padding_mask=key_padding_mask, attn_mask=attn_mask)
# output: [bs x n_heads x q_len x d_v], attn: [bs x n_heads x q_len x q_len], scores: [bs x n_heads x max_q_len x q_len]
# back to the original inputs dimensions
output = output.transpose(1, 2).contiguous().view(bs, -1,
self.n_heads * self.d_v) # output: [bs x q_len x n_heads * d_v]
output = self.to_out(output)
if self.res_attention:
return output, attn_weights, attn_scores
else:
return output, attn_weights
class _ScaledDotProductAttention(nn.Module):
r"""Scaled Dot-Product Attention module (Attention is all you need by Vaswani et al., 2017) with optional residual attention from previous layer
(Realformer: Transformer likes residual attention by He et al, 2020) and locality self sttention (Vision Transformer for Small-Size Datasets
by Lee et al, 2021)"""
def __init__(self, d_model, n_heads, attn_dropout=0., res_attention=False, lsa=False):
super().__init__()
self.attn_dropout = nn.Dropout(attn_dropout)
self.res_attention = res_attention
head_dim = d_model // n_heads
self.scale = nn.Parameter(torch.tensor(head_dim ** -0.5), requires_grad=lsa)
self.lsa = lsa
def forward(self, q: Tensor, k: Tensor, v: Tensor, prev: Optional[Tensor] = None,
key_padding_mask: Optional[Tensor] = None, attn_mask: Optional[Tensor] = None):
'''
Input shape:
q : [bs x n_heads x max_q_len x d_k]
k : [bs x n_heads x d_k x seq_len]
v : [bs x n_heads x seq_len x d_v]
prev : [bs x n_heads x q_len x seq_len]
key_padding_mask: [bs x seq_len]
attn_mask : [1 x seq_len x seq_len]
Output shape:
output: [bs x n_heads x q_len x d_v]
attn : [bs x n_heads x q_len x seq_len]
scores : [bs x n_heads x q_len x seq_len]
'''
# Scaled MatMul (q, k) - similarity scores for all pairs of positions in an input sequence
attn_scores = torch.matmul(q, k) * self.scale # attn_scores : [bs x n_heads x max_q_len x q_len]
# Add pre-softmax attention scores from the previous layer (optional)
if prev is not None: attn_scores = attn_scores + prev
# Attention mask (optional)
if attn_mask is not None: # attn_mask with shape [q_len x seq_len] - only used when q_len == seq_len
if attn_mask.dtype == torch.bool:
attn_scores.masked_fill_(attn_mask, -np.inf)
else:
attn_scores += attn_mask
# Key padding mask (optional)
if key_padding_mask is not None: # mask with shape [bs x q_len] (only when max_w_len == q_len)
attn_scores.masked_fill_(key_padding_mask.unsqueeze(1).unsqueeze(2), -np.inf)
# normalize the attention weights
attn_weights = F.softmax(attn_scores, dim=-1) # attn_weights : [bs x n_heads x max_q_len x q_len]
attn_weights = self.attn_dropout(attn_weights)
# compute the new values given the attention weights
output = torch.matmul(attn_weights, v) # output: [bs x n_heads x max_q_len x d_v]
if self.res_attention:
return output, attn_weights, attn_scores
else:
return output, attn_weights
@@ -0,0 +1,121 @@
__all__ = ['Transpose', 'get_activation_fn', 'moving_avg', 'series_decomp', 'PositionalEncoding', 'SinCosPosEncoding', 'Coord2dPosEncoding', 'Coord1dPosEncoding', 'positional_encoding']
import torch
from torch import nn
import math
class Transpose(nn.Module):
def __init__(self, *dims, contiguous=False):
super().__init__()
self.dims, self.contiguous = dims, contiguous
def forward(self, x):
if self.contiguous: return x.transpose(*self.dims).contiguous()
else: return x.transpose(*self.dims)
def get_activation_fn(activation):
if callable(activation): return activation()
elif activation.lower() == "relu": return nn.ReLU()
elif activation.lower() == "gelu": return nn.GELU()
raise ValueError(f'{activation} is not available. You can use "relu", "gelu", or a callable')
# decomposition
class moving_avg(nn.Module):
"""
Moving average block to highlight the trend of time series
"""
def __init__(self, kernel_size, stride):
super(moving_avg, self).__init__()
self.kernel_size = kernel_size
self.avg = nn.AvgPool1d(kernel_size=kernel_size, stride=stride, padding=0)
def forward(self, x):
# padding on the both ends of time series
front = x[:, 0:1, :].repeat(1, (self.kernel_size - 1) // 2, 1)
end = x[:, -1:, :].repeat(1, (self.kernel_size - 1) // 2, 1)
x = torch.cat([front, x, end], dim=1)
x = self.avg(x.permute(0, 2, 1))
x = x.permute(0, 2, 1)
return x
class series_decomp(nn.Module):
"""
Series decomposition block
"""
def __init__(self, kernel_size):
super(series_decomp, self).__init__()
self.moving_avg = moving_avg(kernel_size, stride=1)
def forward(self, x):
moving_mean = self.moving_avg(x)
res = x - moving_mean
return res, moving_mean
# pos_encoding
def PositionalEncoding(q_len, d_model, normalize=True):
pe = torch.zeros(q_len, d_model)
position = torch.arange(0, q_len).unsqueeze(1)
div_term = torch.exp(torch.arange(0, d_model, 2) * -(math.log(10000.0) / d_model))
pe[:, 0::2] = torch.sin(position * div_term)
pe[:, 1::2] = torch.cos(position * div_term)
if normalize:
pe = pe - pe.mean()
pe = pe / (pe.std() * 10)
return pe
SinCosPosEncoding = PositionalEncoding
def Coord2dPosEncoding(q_len, d_model, exponential=False, normalize=True, eps=1e-3, verbose=False):
x = .5 if exponential else 1
i = 0
for i in range(100):
cpe = 2 * (torch.linspace(0, 1, q_len).reshape(-1, 1) ** x) * (torch.linspace(0, 1, d_model).reshape(1, -1) ** x) - 1
pv(f'{i:4.0f} {x:5.3f} {cpe.mean():+6.3f}', verbose)
if abs(cpe.mean()) <= eps: break
elif cpe.mean() > eps: x += .001
else: x -= .001
i += 1
if normalize:
cpe = cpe - cpe.mean()
cpe = cpe / (cpe.std() * 10)
return cpe
def Coord1dPosEncoding(q_len, exponential=False, normalize=True):
cpe = (2 * (torch.linspace(0, 1, q_len).reshape(-1, 1)**(.5 if exponential else 1)) - 1)
if normalize:
cpe = cpe - cpe.mean()
cpe = cpe / (cpe.std() * 10)
return cpe
def positional_encoding(pe, learn_pe, q_len, d_model):
# Positional encoding
if pe == None:
W_pos = torch.empty((q_len, d_model)) # pe = None and learn_pe = False can be used to measure impact of pe
nn.init.uniform_(W_pos, -0.02, 0.02)
learn_pe = False
elif pe == 'zero':
W_pos = torch.empty((q_len, 1))
nn.init.uniform_(W_pos, -0.02, 0.02)
elif pe == 'zeros':
W_pos = torch.empty((q_len, d_model))
nn.init.uniform_(W_pos, -0.02, 0.02)
elif pe == 'normal' or pe == 'gauss':
W_pos = torch.zeros((q_len, 1))
torch.nn.init.normal_(W_pos, mean=0.0, std=0.1)
elif pe == 'uniform':
W_pos = torch.zeros((q_len, 1))
nn.init.uniform_(W_pos, a=0.0, b=0.1)
elif pe == 'lin1d': W_pos = Coord1dPosEncoding(q_len, exponential=False, normalize=True)
elif pe == 'exp1d': W_pos = Coord1dPosEncoding(q_len, exponential=True, normalize=True)
elif pe == 'lin2d': W_pos = Coord2dPosEncoding(q_len, d_model, exponential=False, normalize=True)
elif pe == 'exp2d': W_pos = Coord2dPosEncoding(q_len, d_model, exponential=True, normalize=True)
elif pe == 'sincos': W_pos = PositionalEncoding(q_len, d_model, normalize=True)
else: raise ValueError(f"{pe} is not a valid pe (positional encoder. Available types: 'gauss'=='normal', \
'zeros', 'zero', uniform', 'lin1d', 'exp1d', 'lin2d', 'exp2d', 'sincos', None.)")
return nn.Parameter(W_pos, requires_grad=learn_pe)
@@ -0,0 +1,63 @@
# code from https://github.com/ts-kim/RevIN, with minor modifications
import torch
import torch.nn as nn
class RevIN(nn.Module):
def __init__(self, num_features: int, eps=1e-5, affine=True, subtract_last=False):
"""
:param num_features: the number of features or channels
:param eps: a value added for numerical stability
:param affine: if True, RevIN has learnable affine parameters
"""
super(RevIN, self).__init__()
self.num_features = num_features
self.eps = eps
self.affine = affine
self.subtract_last = subtract_last
if self.affine:
self._init_params()
def forward(self, x, mode:str):
if mode == 'norm':
self._get_statistics(x)
x = self._normalize(x)
elif mode == 'denorm':
x = self._denormalize(x)
else: raise NotImplementedError
return x
def _init_params(self):
# initialize RevIN params: (C,)
self.affine_weight = nn.Parameter(torch.ones(self.num_features))
self.affine_bias = nn.Parameter(torch.zeros(self.num_features))
def _get_statistics(self, x):
dim2reduce = tuple(range(1, x.ndim-1))
if self.subtract_last:
self.last = x[:,-1,:].unsqueeze(1)
else:
self.mean = torch.mean(x, dim=dim2reduce, keepdim=True).detach()
self.stdev = torch.sqrt(torch.var(x, dim=dim2reduce, keepdim=True, unbiased=False) + self.eps).detach()
def _normalize(self, x):
if self.subtract_last:
x = x - self.last
else:
x = x - self.mean
x = x / self.stdev
if self.affine:
x = x * self.affine_weight
x = x + self.affine_bias
return x
def _denormalize(self, x):
if self.affine:
x = x - self.affine_bias
x = x / (self.affine_weight + self.eps*self.eps)
x = x * self.stdev
if self.subtract_last:
x = x + self.last
else:
x = x + self.mean
return x
@@ -0,0 +1,166 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
import matplotlib.pyplot as plt
import numpy as np
import math
from math import sqrt
from utils.masking import TriangularCausalMask, ProbMask
import os
class FullAttention(nn.Module):
def __init__(self, mask_flag=True, factor=5, scale=None, attention_dropout=0.1, output_attention=False):
super(FullAttention, self).__init__()
self.scale = scale
self.mask_flag = mask_flag
self.output_attention = output_attention
self.dropout = nn.Dropout(attention_dropout)
def forward(self, queries, keys, values, attn_mask):
B, L, H, E = queries.shape
_, S, _, D = values.shape
scale = self.scale or 1. / sqrt(E)
scores = torch.einsum("blhe,bshe->bhls", queries, keys)
if self.mask_flag:
if attn_mask is None:
attn_mask = TriangularCausalMask(B, L, device=queries.device)
scores.masked_fill_(attn_mask.mask, -np.inf)
A = self.dropout(torch.softmax(scale * scores, dim=-1))
V = torch.einsum("bhls,bshd->blhd", A, values)
if self.output_attention:
return (V.contiguous(), A)
else:
return (V.contiguous(), None)
class ProbAttention(nn.Module):
def __init__(self, mask_flag=True, factor=5, scale=None, attention_dropout=0.1, output_attention=False):
super(ProbAttention, self).__init__()
self.factor = factor
self.scale = scale
self.mask_flag = mask_flag
self.output_attention = output_attention
self.dropout = nn.Dropout(attention_dropout)
def _prob_QK(self, Q, K, sample_k, n_top): # n_top: c*ln(L_q)
# Q [B, H, L, D]
B, H, L_K, E = K.shape
_, _, L_Q, _ = Q.shape
# calculate the sampled Q_K
K_expand = K.unsqueeze(-3).expand(B, H, L_Q, L_K, E)
index_sample = torch.randint(L_K, (L_Q, sample_k)) # real U = U_part(factor*ln(L_k))*L_q
K_sample = K_expand[:, :, torch.arange(L_Q).unsqueeze(1), index_sample, :]
Q_K_sample = torch.matmul(Q.unsqueeze(-2), K_sample.transpose(-2, -1)).squeeze()
# find the Top_k query with sparisty measurement
M = Q_K_sample.max(-1)[0] - torch.div(Q_K_sample.sum(-1), L_K)
M_top = M.topk(n_top, sorted=False)[1]
# use the reduced Q to calculate Q_K
Q_reduce = Q[torch.arange(B)[:, None, None],
torch.arange(H)[None, :, None],
M_top, :] # factor*ln(L_q)
Q_K = torch.matmul(Q_reduce, K.transpose(-2, -1)) # factor*ln(L_q)*L_k
return Q_K, M_top
def _get_initial_context(self, V, L_Q):
B, H, L_V, D = V.shape
if not self.mask_flag:
# V_sum = V.sum(dim=-2)
V_sum = V.mean(dim=-2)
contex = V_sum.unsqueeze(-2).expand(B, H, L_Q, V_sum.shape[-1]).clone()
else: # use mask
assert (L_Q == L_V) # requires that L_Q == L_V, i.e. for self-attention only
contex = V.cumsum(dim=-2)
return contex
def _update_context(self, context_in, V, scores, index, L_Q, attn_mask):
B, H, L_V, D = V.shape
if self.mask_flag:
attn_mask = ProbMask(B, H, L_Q, index, scores, device=V.device)
scores.masked_fill_(attn_mask.mask, -np.inf)
attn = torch.softmax(scores, dim=-1) # nn.Softmax(dim=-1)(scores)
context_in[torch.arange(B)[:, None, None],
torch.arange(H)[None, :, None],
index, :] = torch.matmul(attn, V).type_as(context_in)
if self.output_attention:
attns = (torch.ones([B, H, L_V, L_V]) / L_V).type_as(attn).to(attn.device)
attns[torch.arange(B)[:, None, None], torch.arange(H)[None, :, None], index, :] = attn
return (context_in, attns)
else:
return (context_in, None)
def forward(self, queries, keys, values, attn_mask):
B, L_Q, H, D = queries.shape
_, L_K, _, _ = keys.shape
queries = queries.transpose(2, 1)
keys = keys.transpose(2, 1)
values = values.transpose(2, 1)
U_part = self.factor * np.ceil(np.log(L_K)).astype('int').item() # c*ln(L_k)
u = self.factor * np.ceil(np.log(L_Q)).astype('int').item() # c*ln(L_q)
U_part = U_part if U_part < L_K else L_K
u = u if u < L_Q else L_Q
scores_top, index = self._prob_QK(queries, keys, sample_k=U_part, n_top=u)
# add scale factor
scale = self.scale or 1. / sqrt(D)
if scale is not None:
scores_top = scores_top * scale
# get the context
context = self._get_initial_context(values, L_Q)
# update the context with selected top_k queries
context, attn = self._update_context(context, values, scores_top, index, L_Q, attn_mask)
return context.contiguous(), attn
class AttentionLayer(nn.Module):
def __init__(self, attention, d_model, n_heads, d_keys=None,
d_values=None):
super(AttentionLayer, self).__init__()
d_keys = d_keys or (d_model // n_heads)
d_values = d_values or (d_model // n_heads)
self.inner_attention = attention
self.query_projection = nn.Linear(d_model, d_keys * n_heads)
self.key_projection = nn.Linear(d_model, d_keys * n_heads)
self.value_projection = nn.Linear(d_model, d_values * n_heads)
self.out_projection = nn.Linear(d_values * n_heads, d_model)
self.n_heads = n_heads
def forward(self, queries, keys, values, attn_mask):
B, L, _ = queries.shape
_, S, _ = keys.shape
H = self.n_heads
queries = self.query_projection(queries).view(B, L, H, -1)
keys = self.key_projection(keys).view(B, S, H, -1)
values = self.value_projection(values).view(B, S, H, -1)
out, attn = self.inner_attention(
queries,
keys,
values,
attn_mask
)
out = out.view(B, L, -1)
return self.out_projection(out), attn
@@ -0,0 +1,131 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
class ConvLayer(nn.Module):
def __init__(self, c_in):
super(ConvLayer, self).__init__()
self.downConv = nn.Conv1d(in_channels=c_in,
out_channels=c_in,
kernel_size=3,
padding=2,
padding_mode='circular')
self.norm = nn.BatchNorm1d(c_in)
self.activation = nn.ELU()
self.maxPool = nn.MaxPool1d(kernel_size=3, stride=2, padding=1)
def forward(self, x):
x = self.downConv(x.permute(0, 2, 1))
x = self.norm(x)
x = self.activation(x)
x = self.maxPool(x)
x = x.transpose(1, 2)
return x
class EncoderLayer(nn.Module):
def __init__(self, attention, d_model, d_ff=None, dropout=0.1, activation="relu"):
super(EncoderLayer, self).__init__()
d_ff = d_ff or 4 * d_model
self.attention = attention
self.conv1 = nn.Conv1d(in_channels=d_model, out_channels=d_ff, kernel_size=1)
self.conv2 = nn.Conv1d(in_channels=d_ff, out_channels=d_model, kernel_size=1)
self.norm1 = nn.LayerNorm(d_model)
self.norm2 = nn.LayerNorm(d_model)
self.dropout = nn.Dropout(dropout)
self.activation = F.relu if activation == "relu" else F.gelu
def forward(self, x, attn_mask=None):
new_x, attn = self.attention(
x, x, x,
attn_mask=attn_mask
)
x = x + self.dropout(new_x)
y = x = self.norm1(x)
y = self.dropout(self.activation(self.conv1(y.transpose(-1, 1))))
y = self.dropout(self.conv2(y).transpose(-1, 1))
return self.norm2(x + y), attn
class Encoder(nn.Module):
def __init__(self, attn_layers, conv_layers=None, norm_layer=None):
super(Encoder, self).__init__()
self.attn_layers = nn.ModuleList(attn_layers)
self.conv_layers = nn.ModuleList(conv_layers) if conv_layers is not None else None
self.norm = norm_layer
def forward(self, x, attn_mask=None):
# x [B, L, D]
attns = []
if self.conv_layers is not None:
for attn_layer, conv_layer in zip(self.attn_layers, self.conv_layers):
x, attn = attn_layer(x, attn_mask=attn_mask)
x = conv_layer(x)
attns.append(attn)
x, attn = self.attn_layers[-1](x)
attns.append(attn)
else:
for attn_layer in self.attn_layers:
x, attn = attn_layer(x, attn_mask=attn_mask)
attns.append(attn)
if self.norm is not None:
x = self.norm(x)
return x, attns
class DecoderLayer(nn.Module):
def __init__(self, self_attention, cross_attention, d_model, d_ff=None,
dropout=0.1, activation="relu"):
super(DecoderLayer, self).__init__()
d_ff = d_ff or 4 * d_model
self.self_attention = self_attention
self.cross_attention = cross_attention
self.conv1 = nn.Conv1d(in_channels=d_model, out_channels=d_ff, kernel_size=1)
self.conv2 = nn.Conv1d(in_channels=d_ff, out_channels=d_model, kernel_size=1)
self.norm1 = nn.LayerNorm(d_model)
self.norm2 = nn.LayerNorm(d_model)
self.norm3 = nn.LayerNorm(d_model)
self.dropout = nn.Dropout(dropout)
self.activation = F.relu if activation == "relu" else F.gelu
def forward(self, x, cross, x_mask=None, cross_mask=None):
x = x + self.dropout(self.self_attention(
x, x, x,
attn_mask=x_mask
)[0])
x = self.norm1(x)
x = x + self.dropout(self.cross_attention(
x, cross, cross,
attn_mask=cross_mask
)[0])
y = x = self.norm2(x)
y = self.dropout(self.activation(self.conv1(y.transpose(-1, 1))))
y = self.dropout(self.conv2(y).transpose(-1, 1))
return self.norm3(x + y)
class Decoder(nn.Module):
def __init__(self, layers, norm_layer=None, projection=None):
super(Decoder, self).__init__()
self.layers = nn.ModuleList(layers)
self.norm = norm_layer
self.projection = projection
def forward(self, x, cross, x_mask=None, cross_mask=None):
for layer in self.layers:
x = layer(x, cross, x_mask=x_mask, cross_mask=cross_mask)
if self.norm is not None:
x = self.norm(x)
if self.projection is not None:
x = self.projection(x)
return x
@@ -0,0 +1,121 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
from layers.Embed import DataEmbedding, DataEmbedding_wo_pos,DataEmbedding_wo_pos_temp,DataEmbedding_wo_temp
from layers.AutoCorrelation import AutoCorrelation, AutoCorrelationLayer
from layers.Autoformer_EncDec import Encoder, Decoder, EncoderLayer, DecoderLayer, my_Layernorm, series_decomp
import math
import numpy as np
class Model(nn.Module):
"""
Autoformer is the first method to achieve the series-wise connection,
with inherent O(LlogL) complexity
"""
def __init__(self, configs):
super(Model, self).__init__()
self.seq_len = configs.seq_len
self.label_len = configs.label_len
self.pred_len = configs.pred_len
self.output_attention = configs.output_attention
# Decomp
kernel_size = configs.moving_avg
self.decomp = series_decomp(kernel_size)
# Embedding
# The series-wise connection inherently contains the sequential information.
# Thus, we can discard the position embedding of transformers.
if configs.embed_type == 0:
self.enc_embedding = DataEmbedding_wo_pos(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding_wo_pos(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 1:
self.enc_embedding = DataEmbedding(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 2:
self.enc_embedding = DataEmbedding_wo_pos(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding_wo_pos(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 3:
self.enc_embedding = DataEmbedding_wo_temp(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding_wo_temp(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 4:
self.enc_embedding = DataEmbedding_wo_pos_temp(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding_wo_pos_temp(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
# Encoder
self.encoder = Encoder(
[
EncoderLayer(
AutoCorrelationLayer(
AutoCorrelation(False, configs.factor, attention_dropout=configs.dropout,
output_attention=configs.output_attention),
configs.d_model, configs.n_heads),
configs.d_model,
configs.d_ff,
moving_avg=configs.moving_avg,
dropout=configs.dropout,
activation=configs.activation
) for l in range(configs.e_layers)
],
norm_layer=my_Layernorm(configs.d_model)
)
# Decoder
self.decoder = Decoder(
[
DecoderLayer(
AutoCorrelationLayer(
AutoCorrelation(True, configs.factor, attention_dropout=configs.dropout,
output_attention=False),
configs.d_model, configs.n_heads),
AutoCorrelationLayer(
AutoCorrelation(False, configs.factor, attention_dropout=configs.dropout,
output_attention=False),
configs.d_model, configs.n_heads),
configs.d_model,
configs.c_out,
configs.d_ff,
moving_avg=configs.moving_avg,
dropout=configs.dropout,
activation=configs.activation,
)
for l in range(configs.d_layers)
],
norm_layer=my_Layernorm(configs.d_model),
projection=nn.Linear(configs.d_model, configs.c_out, bias=True)
)
def forward(self, x_enc, x_mark_enc, x_dec, x_mark_dec,
enc_self_mask=None, dec_self_mask=None, dec_enc_mask=None):
# decomp init
mean = torch.mean(x_enc, dim=1).unsqueeze(1).repeat(1, self.pred_len, 1)
zeros = torch.zeros([x_dec.shape[0], self.pred_len, x_dec.shape[2]], device=x_enc.device)
seasonal_init, trend_init = self.decomp(x_enc)
# decoder input
trend_init = torch.cat([trend_init[:, -self.label_len:, :], mean], dim=1)
seasonal_init = torch.cat([seasonal_init[:, -self.label_len:, :], zeros], dim=1)
# enc
enc_out = self.enc_embedding(x_enc, x_mark_enc)
enc_out, attns = self.encoder(enc_out, attn_mask=enc_self_mask)
# dec
dec_out = self.dec_embedding(seasonal_init, x_mark_dec)
seasonal_part, trend_part = self.decoder(dec_out, enc_out, x_mask=dec_self_mask, cross_mask=dec_enc_mask,
trend=trend_init)
# final
dec_out = trend_part + seasonal_part
if self.output_attention:
return dec_out[:, -self.pred_len:, :], attns
else:
return dec_out[:, -self.pred_len:, :] # [B, L, D]
@@ -0,0 +1,87 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
import numpy as np
class moving_avg(nn.Module):
"""
Moving average block to highlight the trend of time series
"""
def __init__(self, kernel_size, stride):
super(moving_avg, self).__init__()
self.kernel_size = kernel_size
self.avg = nn.AvgPool1d(kernel_size=kernel_size, stride=stride, padding=0)
def forward(self, x):
# padding on the both ends of time series
front = x[:, 0:1, :].repeat(1, (self.kernel_size - 1) // 2, 1)
end = x[:, -1:, :].repeat(1, (self.kernel_size - 1) // 2, 1)
x = torch.cat([front, x, end], dim=1)
x = self.avg(x.permute(0, 2, 1))
x = x.permute(0, 2, 1)
return x
class series_decomp(nn.Module):
"""
Series decomposition block
"""
def __init__(self, kernel_size):
super(series_decomp, self).__init__()
self.moving_avg = moving_avg(kernel_size, stride=1)
def forward(self, x):
moving_mean = self.moving_avg(x)
res = x - moving_mean
return res, moving_mean
class Model(nn.Module):
"""
Decomposition-Linear
"""
def __init__(self, configs):
super(Model, self).__init__()
self.seq_len = configs.seq_len
self.pred_len = configs.pred_len
# Decompsition Kernel Size
kernel_size = 25
self.decompsition = series_decomp(kernel_size)
self.individual = configs.individual
self.channels = configs.enc_in
if self.individual:
self.Linear_Seasonal = nn.ModuleList()
self.Linear_Trend = nn.ModuleList()
for i in range(self.channels):
self.Linear_Seasonal.append(nn.Linear(self.seq_len,self.pred_len))
self.Linear_Trend.append(nn.Linear(self.seq_len,self.pred_len))
# Use this two lines if you want to visualize the weights
# self.Linear_Seasonal[i].weight = nn.Parameter((1/self.seq_len)*torch.ones([self.pred_len,self.seq_len]))
# self.Linear_Trend[i].weight = nn.Parameter((1/self.seq_len)*torch.ones([self.pred_len,self.seq_len]))
else:
self.Linear_Seasonal = nn.Linear(self.seq_len,self.pred_len)
self.Linear_Trend = nn.Linear(self.seq_len,self.pred_len)
# Use this two lines if you want to visualize the weights
# self.Linear_Seasonal.weight = nn.Parameter((1/self.seq_len)*torch.ones([self.pred_len,self.seq_len]))
# self.Linear_Trend.weight = nn.Parameter((1/self.seq_len)*torch.ones([self.pred_len,self.seq_len]))
def forward(self, x):
# x: [Batch, Input length, Channel]
seasonal_init, trend_init = self.decompsition(x)
seasonal_init, trend_init = seasonal_init.permute(0,2,1), trend_init.permute(0,2,1)
if self.individual:
seasonal_output = torch.zeros([seasonal_init.size(0),seasonal_init.size(1),self.pred_len],dtype=seasonal_init.dtype).to(seasonal_init.device)
trend_output = torch.zeros([trend_init.size(0),trend_init.size(1),self.pred_len],dtype=trend_init.dtype).to(trend_init.device)
for i in range(self.channels):
seasonal_output[:,i,:] = self.Linear_Seasonal[i](seasonal_init[:,i,:])
trend_output[:,i,:] = self.Linear_Trend[i](trend_init[:,i,:])
else:
seasonal_output = self.Linear_Seasonal(seasonal_init)
trend_output = self.Linear_Trend(trend_init)
x = seasonal_output + trend_output
return x.permute(0,2,1) # to [Batch, Output length, Channel]
@@ -0,0 +1,101 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
from utils.masking import TriangularCausalMask, ProbMask
from layers.Transformer_EncDec import Decoder, DecoderLayer, Encoder, EncoderLayer, ConvLayer
from layers.SelfAttention_Family import FullAttention, ProbAttention, AttentionLayer
from layers.Embed import DataEmbedding,DataEmbedding_wo_pos,DataEmbedding_wo_temp,DataEmbedding_wo_pos_temp
import numpy as np
class Model(nn.Module):
"""
Informer with Propspare attention in O(LlogL) complexity
"""
def __init__(self, configs):
super(Model, self).__init__()
self.pred_len = configs.pred_len
self.output_attention = configs.output_attention
# Embedding
if configs.embed_type == 0:
self.enc_embedding = DataEmbedding(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 1:
self.enc_embedding = DataEmbedding(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 2:
self.enc_embedding = DataEmbedding_wo_pos(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding_wo_pos(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 3:
self.enc_embedding = DataEmbedding_wo_temp(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding_wo_temp(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 4:
self.enc_embedding = DataEmbedding_wo_pos_temp(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding_wo_pos_temp(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
# Encoder
self.encoder = Encoder(
[
EncoderLayer(
AttentionLayer(
ProbAttention(False, configs.factor, attention_dropout=configs.dropout,
output_attention=configs.output_attention),
configs.d_model, configs.n_heads),
configs.d_model,
configs.d_ff,
dropout=configs.dropout,
activation=configs.activation
) for l in range(configs.e_layers)
],
[
ConvLayer(
configs.d_model
) for l in range(configs.e_layers - 1)
] if configs.distil else None,
norm_layer=torch.nn.LayerNorm(configs.d_model)
)
# Decoder
self.decoder = Decoder(
[
DecoderLayer(
AttentionLayer(
ProbAttention(True, configs.factor, attention_dropout=configs.dropout, output_attention=False),
configs.d_model, configs.n_heads),
AttentionLayer(
ProbAttention(False, configs.factor, attention_dropout=configs.dropout, output_attention=False),
configs.d_model, configs.n_heads),
configs.d_model,
configs.d_ff,
dropout=configs.dropout,
activation=configs.activation,
)
for l in range(configs.d_layers)
],
norm_layer=torch.nn.LayerNorm(configs.d_model),
projection=nn.Linear(configs.d_model, configs.c_out, bias=True)
)
def forward(self, x_enc, x_mark_enc, x_dec, x_mark_dec,
enc_self_mask=None, dec_self_mask=None, dec_enc_mask=None):
enc_out = self.enc_embedding(x_enc, x_mark_enc)
enc_out, attns = self.encoder(enc_out, attn_mask=enc_self_mask)
dec_out = self.dec_embedding(x_dec, x_mark_dec)
dec_out = self.decoder(dec_out, enc_out, x_mask=dec_self_mask, cross_mask=dec_enc_mask)
if self.output_attention:
return dec_out[:, -self.pred_len:, :], attns
else:
return dec_out[:, -self.pred_len:, :] # [B, L, D]
@@ -0,0 +1,21 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
import numpy as np
class Model(nn.Module):
"""
Just one Linear layer
"""
def __init__(self, configs):
super(Model, self).__init__()
self.seq_len = configs.seq_len
self.pred_len = configs.pred_len
self.Linear = nn.Linear(self.seq_len, self.pred_len)
# Use this line if you want to visualize the weights
# self.Linear.weight = nn.Parameter((1/self.seq_len)*torch.ones([self.pred_len,self.seq_len]))
def forward(self, x):
# x: [Batch, Input length, Channel]
x = self.Linear(x.permute(0,2,1)).permute(0,2,1)
return x # [Batch, Output length, Channel]
@@ -0,0 +1,24 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
import numpy as np
class Model(nn.Module):
"""
Normalization-Linear
"""
def __init__(self, configs):
super(Model, self).__init__()
self.seq_len = configs.seq_len
self.pred_len = configs.pred_len
self.Linear = nn.Linear(self.seq_len, self.pred_len)
# Use this line if you want to visualize the weights
# self.Linear.weight = nn.Parameter((1/self.seq_len)*torch.ones([self.pred_len,self.seq_len]))
def forward(self, x):
# x: [Batch, Input length, Channel]
seq_last = x[:,-1:,:].detach()
x = x - seq_last
x = self.Linear(x.permute(0,2,1)).permute(0,2,1)
x = x + seq_last
return x # [Batch, Output length, Channel]
@@ -0,0 +1,127 @@
__all__ = ['PatchTST']
# Cell
from typing import Callable, Optional
import torch
from torch import nn
from torch import Tensor
import torch.nn.functional as F
import numpy as np
from models.third_party.patch_tst.layers.PatchTST_backbone import PatchTST_backbone
from models.third_party.patch_tst.layers.PatchTST_layers import series_decomp
class Model(nn.Module):
def __init__(self, input_dim: int, output_dim: int, configs, max_seq_len: Optional[int] = 1024,
d_k: Optional[int] = None, d_v: Optional[int] = None,
norm: str = 'BatchNorm', attn_dropout: float = 0.,
act: str = "gelu", key_padding_mask: bool = 'auto', padding_var: Optional[int] = None,
attn_mask: Optional[Tensor] = None, res_attention: bool = True,
pre_norm: bool = False, store_attn: bool = False, pe: str = 'zeros', learn_pe: bool = True,
pretrain_head: bool = False, head_type='flatten', verbose: bool = False, **kwargs):
super().__init__()
# load parameters
c_in = input_dim
context_window = configs['seq_len']
target_window = configs['pred_len']
dec_out = output_dim
seq_pred = configs["seq_pred"]
n_layers = configs['e_layers']
n_heads = configs['n_heads']
d_model = configs['d_model']
d_ff = configs['d_ff']
dropout = configs['dropout']
fc_dropout = configs['fc_dropout']
head_dropout = configs['head_dropout']
individual = configs['individual']
patch_len = configs['patch_len']
stride = configs['stride']
padding_patch = configs['padding_patch']
revin = configs['revin']
affine = configs['affine']
subtract_last = configs['subtract_last']
decomposition = configs['decomposition']
kernel_size = configs['kernel_size']
# model
self.decomposition = decomposition
if self.decomposition:
self.decomp_module = series_decomp(kernel_size)
self.model_trend = PatchTST_backbone(c_in=c_in, context_window=context_window, target_window=target_window,
# extras
dec_out=dec_out,
seq_pred=seq_pred,
#
patch_len=patch_len, stride=stride,
max_seq_len=max_seq_len, n_layers=n_layers, d_model=d_model,
n_heads=n_heads, d_k=d_k, d_v=d_v, d_ff=d_ff, norm=norm,
attn_dropout=attn_dropout,
dropout=dropout, act=act, key_padding_mask=key_padding_mask,
padding_var=padding_var,
attn_mask=attn_mask, res_attention=res_attention, pre_norm=pre_norm,
store_attn=store_attn,
pe=pe, learn_pe=learn_pe, fc_dropout=fc_dropout,
head_dropout=head_dropout, padding_patch=padding_patch,
pretrain_head=pretrain_head, head_type=head_type,
individual=individual, revin=revin, affine=affine,
subtract_last=subtract_last, verbose=verbose, **kwargs)
self.model_res = PatchTST_backbone(c_in=c_in, context_window=context_window, target_window=target_window,
# extras
dec_out=dec_out,
seq_pred=seq_pred,
#
patch_len=patch_len, stride=stride,
max_seq_len=max_seq_len, n_layers=n_layers, d_model=d_model,
n_heads=n_heads, d_k=d_k, d_v=d_v, d_ff=d_ff, norm=norm,
attn_dropout=attn_dropout,
dropout=dropout, act=act, key_padding_mask=key_padding_mask,
padding_var=padding_var,
attn_mask=attn_mask, res_attention=res_attention, pre_norm=pre_norm,
store_attn=store_attn,
pe=pe, learn_pe=learn_pe, fc_dropout=fc_dropout,
head_dropout=head_dropout, padding_patch=padding_patch,
pretrain_head=pretrain_head, head_type=head_type, individual=individual,
revin=revin, affine=affine,
subtract_last=subtract_last, verbose=verbose, **kwargs)
else:
self.model = PatchTST_backbone(c_in=c_in, context_window=context_window, target_window=target_window,
# extras
dec_out=dec_out,
seq_pred=seq_pred,
#
patch_len=patch_len, stride=stride,
max_seq_len=max_seq_len, n_layers=n_layers, d_model=d_model,
n_heads=n_heads, d_k=d_k, d_v=d_v, d_ff=d_ff, norm=norm,
attn_dropout=attn_dropout,
dropout=dropout, act=act, key_padding_mask=key_padding_mask,
padding_var=padding_var,
attn_mask=attn_mask, res_attention=res_attention, pre_norm=pre_norm,
store_attn=store_attn,
pe=pe, learn_pe=learn_pe, fc_dropout=fc_dropout, head_dropout=head_dropout,
padding_patch=padding_patch,
pretrain_head=pretrain_head, head_type=head_type, individual=individual,
revin=revin, affine=affine,
subtract_last=subtract_last, verbose=verbose, **kwargs)
def forward(self, x): # x: [Batch, Input length, Channel]
if self.decomposition:
res_init, trend_init = self.decomp_module(x)
res_init, trend_init = res_init.permute(0, 2, 1), trend_init.permute(0, 2,
1) # x: [Batch, Channel, Input length]
res = self.model_res(res_init)
trend = self.model_trend(trend_init)
x = res + trend
x = x.permute(0, 2, 1) # x: [Batch, Input length, Channel]
else:
x = x.permute(0, 2, 1) # x: [Batch, Channel, Input length]
x = self.model(x)
x = x.permute(0, 2, 1) # x: [Batch, Input length, Channel]
return x
@@ -0,0 +1,120 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
import numpy as np
from tqdm import tqdm
import pmdarima as pm
import threading
from sklearn.ensemble import GradientBoostingRegressor
class Naive_repeat(nn.Module):
def __init__(self, configs):
super(Naive_repeat, self).__init__()
self.pred_len = configs.pred_len
def forward(self, x):
B,L,D = x.shape
x = x[:,-1,:].reshape(B,1,D).repeat(self.pred_len,axis=1)
return x # [B, L, D]
class Naive_thread(threading.Thread):
def __init__(self,func,args=()):
super(Naive_thread,self).__init__()
self.func = func
self.args = args
def run(self):
self.results = self.func(*self.args)
def return_result(self):
threading.Thread.join(self)
return self.results
def _arima(seq,pred_len,bt,i):
model = pm.auto_arima(seq)
forecasts = model.predict(pred_len)
return forecasts,bt,i
class Arima(nn.Module):
"""
Extremely slow, please sample < 0.1
"""
def __init__(self, configs):
super(Arima, self).__init__()
self.pred_len = configs.pred_len
def forward(self, x):
result = np.zeros([x.shape[0],self.pred_len,x.shape[2]])
threads = []
for bt,seqs in tqdm(enumerate(x)):
for i in range(seqs.shape[-1]):
seq = seqs[:,i]
one_seq = Naive_thread(func=_arima,args=(seq,self.pred_len,bt,i))
threads.append(one_seq)
threads[-1].start()
for every_thread in tqdm(threads):
forcast,bt,i = every_thread.return_result()
result[bt,:,i] = forcast
return result # [B, L, D]
def _sarima(season,seq,pred_len,bt,i):
model = pm.auto_arima(seq, seasonal=True, m=season)
forecasts = model.predict(pred_len)
return forecasts,bt,i
class SArima(nn.Module):
"""
Extremely extremely slow, please sample < 0.01
"""
def __init__(self, configs):
super(SArima, self).__init__()
self.pred_len = configs.pred_len
self.seq_len = configs.seq_len
self.season = 24
if 'Ettm' in configs.data_path:
self.season = 12
elif 'ILI' in configs.data_path:
self.season = 1
if self.season >= self.seq_len:
self.season = 1
def forward(self, x):
result = np.zeros([x.shape[0],self.pred_len,x.shape[2]])
threads = []
for bt,seqs in tqdm(enumerate(x)):
for i in range(seqs.shape[-1]):
seq = seqs[:,i]
one_seq = Naive_thread(func=_sarima,args=(self.season,seq,self.pred_len,bt,i))
threads.append(one_seq)
threads[-1].start()
for every_thread in tqdm(threads):
forcast,bt,i = every_thread.return_result()
result[bt,:,i] = forcast
return result # [B, L, D]
def _gbrt(seq,seq_len,pred_len,bt,i):
model = GradientBoostingRegressor()
model.fit(np.arange(seq_len).reshape(-1,1),seq.reshape(-1,1))
forecasts = model.predict(np.arange(seq_len,seq_len+pred_len).reshape(-1,1))
return forecasts,bt,i
class GBRT(nn.Module):
def __init__(self, configs):
super(GBRT, self).__init__()
self.seq_len = configs.seq_len
self.pred_len = configs.pred_len
def forward(self, x):
result = np.zeros([x.shape[0],self.pred_len,x.shape[2]])
threads = []
for bt,seqs in tqdm(enumerate(x)):
for i in range(seqs.shape[-1]):
seq = seqs[:,i]
one_seq = Naive_thread(func=_gbrt,args=(seq,self.seq_len,self.pred_len,bt,i))
threads.append(one_seq)
threads[-1].start()
for every_thread in tqdm(threads):
forcast,bt,i = every_thread.return_result()
result[bt,:,i] = forcast
return result # [B, L, D]
@@ -0,0 +1,94 @@
import torch
import torch.nn as nn
import torch.nn.functional as F
from layers.Transformer_EncDec import Decoder, DecoderLayer, Encoder, EncoderLayer, ConvLayer
from layers.SelfAttention_Family import FullAttention, AttentionLayer
from layers.Embed import DataEmbedding,DataEmbedding_wo_pos,DataEmbedding_wo_temp,DataEmbedding_wo_pos_temp
import numpy as np
class Model(nn.Module):
"""
Vanilla Transformer with O(L^2) complexity
"""
def __init__(self, configs):
super(Model, self).__init__()
self.pred_len = configs.pred_len
self.output_attention = configs.output_attention
# Embedding
if configs.embed_type == 0:
self.enc_embedding = DataEmbedding(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 1:
self.enc_embedding = DataEmbedding(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 2:
self.enc_embedding = DataEmbedding_wo_pos(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding_wo_pos(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 3:
self.enc_embedding = DataEmbedding_wo_temp(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding_wo_temp(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
elif configs.embed_type == 4:
self.enc_embedding = DataEmbedding_wo_pos_temp(configs.enc_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
self.dec_embedding = DataEmbedding_wo_pos_temp(configs.dec_in, configs.d_model, configs.embed, configs.freq,
configs.dropout)
# Encoder
self.encoder = Encoder(
[
EncoderLayer(
AttentionLayer(
FullAttention(False, configs.factor, attention_dropout=configs.dropout,
output_attention=configs.output_attention), configs.d_model, configs.n_heads),
configs.d_model,
configs.d_ff,
dropout=configs.dropout,
activation=configs.activation
) for l in range(configs.e_layers)
],
norm_layer=torch.nn.LayerNorm(configs.d_model)
)
# Decoder
self.decoder = Decoder(
[
DecoderLayer(
AttentionLayer(
FullAttention(True, configs.factor, attention_dropout=configs.dropout, output_attention=False),
configs.d_model, configs.n_heads),
AttentionLayer(
FullAttention(False, configs.factor, attention_dropout=configs.dropout, output_attention=False),
configs.d_model, configs.n_heads),
configs.d_model,
configs.d_ff,
dropout=configs.dropout,
activation=configs.activation,
)
for l in range(configs.d_layers)
],
norm_layer=torch.nn.LayerNorm(configs.d_model),
projection=nn.Linear(configs.d_model, configs.c_out, bias=True)
)
def forward(self, x_enc, x_mark_enc, x_dec, x_mark_dec,
enc_self_mask=None, dec_self_mask=None, dec_enc_mask=None):
enc_out = self.enc_embedding(x_enc, x_mark_enc)
enc_out, attns = self.encoder(enc_out, attn_mask=enc_self_mask)
dec_out = self.dec_embedding(x_dec, x_mark_dec)
dec_out = self.decoder(dec_out, enc_out, x_mask=dec_self_mask, cross_mask=dec_enc_mask)
if self.output_attention:
return dec_out[:, -self.pred_len:, :], attns
else:
return dec_out[:, -self.pred_len:, :] # [B, L, D]
Submodule code/new_realtime/models/third_party/patch_tst_raw added at 204c21efe0
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APPENDIX: How to apply the Apache License to your work.
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Licensed under the Apache License, Version 2.0 (the "License");
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+5
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@@ -0,0 +1,5 @@
TFT for PyTorch
This repository includes software from https://github.com/google-research/google-research/tree/master/tft licensed under the Apache 2.0 License.
This repository contains code from https://github.com/rwightman/pytorch-image-models/blob/master/timm/utils/model_ema.py under the Apache 2.0 License.
+3
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@@ -0,0 +1,3 @@
This folder contains code copied from NVIDIA's Temporal Fusion Transformer implementation, licensed under Apache 2.0.
All rights belong to NVIDIA Corporation.
Modifications are noted in the file headers.
+525
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@@ -0,0 +1,525 @@
# Copyright (c) 2021-2022, NVIDIA CORPORATION. All rights reserved.
#
# Licensed under the Apache License, Version 2.0 (the "License");
# you may not use this file except in compliance with the License.
# You may obtain a copy of the License at
#
# http://www.apache.org/licenses/LICENSE-2.0
#
# Unless required by applicable law or agreed to in writing, software
# distributed under the License is distributed on an "AS IS" BASIS,
# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
# See the License for the specific language governing permissions and
# limitations under the License.
# Modified by Alexander Blank, 2025.
# Modifications:
# - added support for multiple outputs
# - added support for mode configurable targets
# - added support for single dimension, non-quantile outputs
# - added support for target agnostic predictions, for cases, where the target does not become known after prediction
import os
import torch
import torch.nn as nn
import torch.nn.functional as F
from torch import Tensor
from torch.nn.parameter import UninitializedParameter
from typing import Dict, Tuple, Optional, List
MAKE_CONVERT_COMPATIBLE = os.environ.get("TFT_SCRIPTING", None) is not None
from torch.nn import LayerNorm
class MaybeLayerNorm(nn.Module):
def __init__(self, output_size, hidden_size, eps):
super().__init__()
if output_size and output_size == 1:
self.ln = nn.Identity()
else:
self.ln = LayerNorm(output_size if output_size else hidden_size, eps=eps)
def forward(self, x):
return self.ln(x)
class GLU(nn.Module):
def __init__(self, hidden_size, output_size):
super().__init__()
self.lin = nn.Linear(hidden_size, output_size * 2)
def forward(self, x: Tensor) -> Tensor:
x = self.lin(x)
x = F.glu(x)
return x
class GRN(nn.Module):
def __init__(self,
input_size,
hidden_size,
output_size=None,
context_hidden_size=None,
dropout=0.0, ):
super().__init__()
self.layer_norm = MaybeLayerNorm(output_size, hidden_size, eps=1e-3)
self.lin_a = nn.Linear(input_size, hidden_size)
if context_hidden_size is not None:
self.lin_c = nn.Linear(context_hidden_size, hidden_size, bias=False)
else:
self.lin_c = nn.Identity()
self.lin_i = nn.Linear(hidden_size, hidden_size)
self.glu = GLU(hidden_size, output_size if output_size else hidden_size)
self.dropout = nn.Dropout(dropout)
self.out_proj = nn.Linear(input_size, output_size) if output_size else None
def forward(self, a: Tensor, c: Optional[Tensor] = None):
x = self.lin_a(a)
if c is not None:
x = x + self.lin_c(c).unsqueeze(1)
x = F.elu(x)
x = self.lin_i(x)
x = self.dropout(x)
x = self.glu(x)
y = a if self.out_proj is None else self.out_proj(a)
x = x + y
return self.layer_norm(x)
# @torch.jit.script #Currently broken with autocast
def fused_pointwise_linear_v1(x, a, b):
out = torch.mul(x.unsqueeze(-1), a)
out = out + b
return out
@torch.jit.script
def fused_pointwise_linear_v2(x, a, b):
out = x.unsqueeze(3) * a
out = out + b
return out
class TFTEmbedding(nn.Module):
def __init__(self, config, initialize_cont_params=True):
# initialize_cont_params=False prevents form initializing parameters inside this class
# so they can be lazily initialized in LazyEmbedding module
super().__init__()
self.s_cat_inp_lens = config.static_categorical_inp_lens
self.t_cat_k_inp_lens = config.temporal_known_categorical_inp_lens
self.t_cat_o_inp_lens = config.temporal_observed_categorical_inp_lens
self.s_cont_inp_size = config.static_continuous_inp_size
self.t_cont_k_inp_size = config.temporal_known_continuous_inp_size
self.t_cont_o_inp_size = config.temporal_observed_continuous_inp_size
self.t_tgt_size = config.temporal_target_size
self.hidden_size = config.hidden_size
# There are 7 types of input:
# 1. Static categorical
# 2. Static continuous
# 3. Temporal known a priori categorical
# 4. Temporal known a priori continuous
# 5. Temporal observed categorical
# 6. Temporal observed continuous
# 7. Temporal observed targets (time series obseved so far)
self.s_cat_embed = nn.ModuleList([
nn.Embedding(n, self.hidden_size) for n in self.s_cat_inp_lens]) if self.s_cat_inp_lens else None
self.t_cat_k_embed = nn.ModuleList([
nn.Embedding(n, self.hidden_size) for n in self.t_cat_k_inp_lens]) if self.t_cat_k_inp_lens else None
self.t_cat_o_embed = nn.ModuleList([
nn.Embedding(n, self.hidden_size) for n in self.t_cat_o_inp_lens]) if self.t_cat_o_inp_lens else None
if initialize_cont_params:
self.s_cont_embedding_vectors = nn.Parameter(
torch.Tensor(self.s_cont_inp_size, self.hidden_size)) if self.s_cont_inp_size else None
self.t_cont_k_embedding_vectors = nn.Parameter(
torch.Tensor(self.t_cont_k_inp_size, self.hidden_size)) if self.t_cont_k_inp_size else None
self.t_cont_o_embedding_vectors = nn.Parameter(
torch.Tensor(self.t_cont_o_inp_size, self.hidden_size)) if self.t_cont_o_inp_size else None
self.t_tgt_embedding_vectors = nn.Parameter(torch.Tensor(self.t_tgt_size, self.hidden_size))
self.s_cont_embedding_bias = nn.Parameter(
torch.zeros(self.s_cont_inp_size, self.hidden_size)) if self.s_cont_inp_size else None
self.t_cont_k_embedding_bias = nn.Parameter(
torch.zeros(self.t_cont_k_inp_size, self.hidden_size)) if self.t_cont_k_inp_size else None
self.t_cont_o_embedding_bias = nn.Parameter(
torch.zeros(self.t_cont_o_inp_size, self.hidden_size)) if self.t_cont_o_inp_size else None
self.t_tgt_embedding_bias = nn.Parameter(torch.zeros(self.t_tgt_size, self.hidden_size))
self.reset_parameters()
def reset_parameters(self):
if self.s_cont_embedding_vectors is not None:
torch.nn.init.xavier_normal_(self.s_cont_embedding_vectors)
torch.nn.init.zeros_(self.s_cont_embedding_bias)
if self.t_cont_k_embedding_vectors is not None:
torch.nn.init.xavier_normal_(self.t_cont_k_embedding_vectors)
torch.nn.init.zeros_(self.t_cont_k_embedding_bias)
if self.t_cont_o_embedding_vectors is not None:
torch.nn.init.xavier_normal_(self.t_cont_o_embedding_vectors)
torch.nn.init.zeros_(self.t_cont_o_embedding_bias)
if self.t_tgt_embedding_vectors is not None:
torch.nn.init.xavier_normal_(self.t_tgt_embedding_vectors)
torch.nn.init.zeros_(self.t_tgt_embedding_bias)
if self.s_cat_embed is not None:
for module in self.s_cat_embed:
module.reset_parameters()
if self.t_cat_k_embed is not None:
for module in self.t_cat_k_embed:
module.reset_parameters()
if self.t_cat_o_embed is not None:
for module in self.t_cat_o_embed:
module.reset_parameters()
def _apply_embedding(self,
cat: Optional[Tensor],
cont: Optional[Tensor],
cat_emb: Optional[nn.ModuleList],
cont_emb: Tensor,
cont_bias: Tensor,
) -> Tuple[Optional[Tensor], Optional[Tensor]]:
e_cat = torch.stack([embed(cat[..., i]) for i, embed in enumerate(cat_emb)],
dim=-2) if cat is not None else None
if cont is not None:
# the line below is equivalent to following einsums
# e_cont = torch.einsum('btf,fh->bthf', cont, cont_emb)
# e_cont = torch.einsum('bf,fh->bhf', cont, cont_emb)
if MAKE_CONVERT_COMPATIBLE:
e_cont = torch.mul(cont.unsqueeze(-1), cont_emb)
e_cont = e_cont + cont_bias
else:
e_cont = fused_pointwise_linear_v1(cont, cont_emb, cont_bias)
else:
e_cont = None
if e_cat is not None and e_cont is not None:
return torch.cat([e_cat, e_cont], dim=-2)
elif e_cat is not None:
return e_cat
elif e_cont is not None:
return e_cont
else:
return None
def forward(self, x: Dict[str, Tensor], use_target: bool = False):
# Extract inputs
s_cat_inp = x.get('s_cat', None)
s_cont_inp = x.get('s_cont', None)
t_cat_k_inp = x.get('k_cat', None)
t_cont_k_inp = x.get('k_cont', None)
t_cat_o_inp = x.get('o_cat', None)
t_cont_o_inp = x.get('o_cont', None)
# Only use target if teacher forcing is enabled.
# When disabled, we ignore target values.
if use_target:
t_tgt_obs = x['target'] # Must be present when using teacher forcing
else:
t_tgt_obs = None
# For static inputs, take the first timestep
s_cat_inp = s_cat_inp[:, 0, :] if s_cat_inp is not None else None
s_cont_inp = s_cont_inp[:, 0, :] if s_cont_inp is not None else None
# Apply embeddings for static and known/observed temporal features
s_inp = self._apply_embedding(s_cat_inp,
s_cont_inp,
self.s_cat_embed,
self.s_cont_embedding_vectors,
self.s_cont_embedding_bias)
t_known_inp = self._apply_embedding(t_cat_k_inp,
t_cont_k_inp,
self.t_cat_k_embed,
self.t_cont_k_embedding_vectors,
self.t_cont_k_embedding_bias)
t_observed_inp = self._apply_embedding(t_cat_o_inp,
t_cont_o_inp,
self.t_cat_o_embed,
self.t_cont_o_embedding_vectors,
self.t_cont_o_embedding_bias)
# Compute the target embedding only if teacher forcing is enabled.
if use_target and t_tgt_obs is not None:
if MAKE_CONVERT_COMPATIBLE:
t_observed_tgt = torch.matmul(t_tgt_obs.unsqueeze(3).unsqueeze(4),
self.t_tgt_embedding_vectors.unsqueeze(1)).squeeze(3)
t_observed_tgt = t_observed_tgt + self.t_tgt_embedding_bias
else:
t_observed_tgt = fused_pointwise_linear_v2(t_tgt_obs,
self.t_tgt_embedding_vectors,
self.t_tgt_embedding_bias)
else:
t_observed_tgt = None
return s_inp, t_known_inp, t_observed_inp, t_observed_tgt
class LazyEmbedding(nn.modules.lazy.LazyModuleMixin, TFTEmbedding):
cls_to_become = TFTEmbedding
def __init__(self, config):
super().__init__(config, initialize_cont_params=False)
if config.static_continuous_inp_size:
self.s_cont_embedding_vectors = UninitializedParameter()
self.s_cont_embedding_bias = UninitializedParameter()
else:
self.s_cont_embedding_vectors = None
self.s_cont_embedding_bias = None
if config.temporal_known_continuous_inp_size:
self.t_cont_k_embedding_vectors = UninitializedParameter()
self.t_cont_k_embedding_bias = UninitializedParameter()
else:
self.t_cont_k_embedding_vectors = None
self.t_cont_k_embedding_bias = None
if config.temporal_observed_continuous_inp_size:
self.t_cont_o_embedding_vectors = UninitializedParameter()
self.t_cont_o_embedding_bias = UninitializedParameter()
else:
self.t_cont_o_embedding_vectors = None
self.t_cont_o_embedding_bias = None
self.t_tgt_embedding_vectors = UninitializedParameter()
self.t_tgt_embedding_bias = UninitializedParameter()
def initialize_parameters(self, x):
if self.has_uninitialized_params():
s_cont_inp = x.get('s_cont', None)
t_cont_k_inp = x.get('k_cont', None)
t_cont_o_inp = x.get('o_cont', None)
t_tgt_obs = x['target'] # Has to be present
if s_cont_inp is not None:
self.s_cont_embedding_vectors.materialize((s_cont_inp.shape[-1], self.hidden_size))
self.s_cont_embedding_bias.materialize((s_cont_inp.shape[-1], self.hidden_size))
if t_cont_k_inp is not None:
self.t_cont_k_embedding_vectors.materialize((t_cont_k_inp.shape[-1], self.hidden_size))
self.t_cont_k_embedding_bias.materialize((t_cont_k_inp.shape[-1], self.hidden_size))
if t_cont_o_inp is not None:
self.t_cont_o_embedding_vectors.materialize((t_cont_o_inp.shape[-1], self.hidden_size))
self.t_cont_o_embedding_bias.materialize((t_cont_o_inp.shape[-1], self.hidden_size))
self.t_tgt_embedding_vectors.materialize((t_tgt_obs.shape[-1], self.hidden_size))
self.t_tgt_embedding_bias.materialize((t_tgt_obs.shape[-1], self.hidden_size))
self.reset_parameters()
# def forward(self, x: Dict[str, Tensor], use_target: bool = True):
# return super().forward(x, use_target=use_target)
class VariableSelectionNetwork(nn.Module):
def __init__(self, config, num_inputs):
super().__init__()
self.joint_grn = GRN(config.hidden_size * num_inputs, config.hidden_size, output_size=num_inputs,
context_hidden_size=config.hidden_size)
self.var_grns = nn.ModuleList(
[GRN(config.hidden_size, config.hidden_size, dropout=config.dropout) for _ in range(num_inputs)])
def forward(self, x: Tensor, context: Optional[Tensor] = None):
Xi = torch.flatten(x, start_dim=-2)
grn_outputs = self.joint_grn(Xi, c=context)
sparse_weights = F.softmax(grn_outputs, dim=-1)
transformed_embed_list = [m(x[..., i, :]) for i, m in enumerate(self.var_grns)]
transformed_embed = torch.stack(transformed_embed_list, dim=-1)
# the line below performs batched matrix vector multiplication
# for temporal features it's bthf,btf->bth
# for static features it's bhf,bf->bh
variable_ctx = torch.matmul(transformed_embed, sparse_weights.unsqueeze(-1)).squeeze(-1)
return variable_ctx, sparse_weights
class StaticCovariateEncoder(nn.Module):
def __init__(self, config):
super().__init__()
self.vsn = VariableSelectionNetwork(config, config.num_static_vars)
self.context_grns = nn.ModuleList(
[GRN(config.hidden_size, config.hidden_size, dropout=config.dropout) for _ in range(4)])
def forward(self, x: Tensor) -> Tuple[Tensor, Tensor, Tensor, Tensor]:
variable_ctx, sparse_weights = self.vsn(x)
# Context vectors:
# variable selection context
# enrichment context
# state_c context
# state_h context
cs, ce, ch, cc = [m(variable_ctx) for m in self.context_grns]
return cs, ce, ch, cc
class InterpretableMultiHeadAttention(nn.Module):
def __init__(self, config):
super().__init__()
self.n_head = config.n_head
assert config.hidden_size % config.n_head == 0
self.d_head = config.hidden_size // config.n_head
self.qkv_linears = nn.Linear(config.hidden_size, (2 * self.n_head + 1) * self.d_head, bias=False)
self.out_proj = nn.Linear(self.d_head, config.hidden_size, bias=False)
self.attn_dropout = nn.Dropout(config.attn_dropout)
self.out_dropout = nn.Dropout(config.dropout)
self.scale = self.d_head ** -0.5
self.register_buffer("_mask",
torch.triu(torch.full((config.example_length, config.example_length), float('-inf')),
1).unsqueeze(0))
def forward(self, x: Tensor) -> Tuple[Tensor, Tensor]:
bs, t, h_size = x.shape
qkv = self.qkv_linears(x)
q, k, v = qkv.split((self.n_head * self.d_head, self.n_head * self.d_head, self.d_head), dim=-1)
q = q.view(bs, t, self.n_head, self.d_head)
k = k.view(bs, t, self.n_head, self.d_head)
v = v.view(bs, t, self.d_head)
# attn_score = torch.einsum('bind,bjnd->bnij', q, k)
attn_score = torch.matmul(q.permute((0, 2, 1, 3)), k.permute((0, 2, 3, 1)))
attn_score.mul_(self.scale)
attn_score = attn_score + self._mask
attn_prob = F.softmax(attn_score, dim=3)
attn_prob = self.attn_dropout(attn_prob)
# attn_vec = torch.einsum('bnij,bjd->bnid', attn_prob, v)
attn_vec = torch.matmul(attn_prob, v.unsqueeze(1))
m_attn_vec = torch.mean(attn_vec, dim=1)
out = self.out_proj(m_attn_vec)
out = self.out_dropout(out)
return out, attn_prob
class TFTBack(nn.Module):
def __init__(self, config):
super().__init__()
self.encoder_length = config.encoder_length
self.history_vsn = VariableSelectionNetwork(config, config.num_historic_vars)
self.history_encoder = nn.LSTM(config.hidden_size, config.hidden_size, batch_first=True)
self.future_vsn = VariableSelectionNetwork(config, config.num_future_vars)
self.future_encoder = nn.LSTM(config.hidden_size, config.hidden_size, batch_first=True)
self.input_gate = GLU(config.hidden_size, config.hidden_size)
self.input_gate_ln = LayerNorm(config.hidden_size, eps=1e-3)
self.enrichment_grn = GRN(config.hidden_size,
config.hidden_size,
context_hidden_size=config.hidden_size,
dropout=config.dropout)
self.attention = InterpretableMultiHeadAttention(config)
self.attention_gate = GLU(config.hidden_size, config.hidden_size)
self.attention_ln = LayerNorm(config.hidden_size, eps=1e-3)
self.positionwise_grn = GRN(config.hidden_size,
config.hidden_size,
dropout=config.dropout)
self.decoder_gate = GLU(config.hidden_size, config.hidden_size)
self.decoder_ln = LayerNorm(config.hidden_size, eps=1e-3)
self.quantiles = config.quantiles
self.target_size = config.target_size
if self.quantiles is not None:
self.output = nn.Linear(config.hidden_size, len(config.quantiles) * config.target_size)
else:
self.output = nn.Linear(config.hidden_size, config.target_size)
def forward(self, historical_inputs, cs, ch, cc, ce, future_inputs):
historical_features, _ = self.history_vsn(historical_inputs, cs)
history, state = self.history_encoder(historical_features, (ch, cc))
future_features, _ = self.future_vsn(future_inputs, cs)
future, _ = self.future_encoder(future_features, state)
torch.cuda.synchronize()
# skip connection
input_embedding = torch.cat([historical_features, future_features], dim=1)
temporal_features = torch.cat([history, future], dim=1)
temporal_features = self.input_gate(temporal_features)
temporal_features = temporal_features + input_embedding
temporal_features = self.input_gate_ln(temporal_features)
# Static enrichment
enriched = self.enrichment_grn(temporal_features, c=ce)
# Temporal self attention
x, _ = self.attention(enriched)
# Don't compute hictorical quantiles
x = x[:, self.encoder_length:, :]
temporal_features = temporal_features[:, self.encoder_length:, :]
enriched = enriched[:, self.encoder_length:, :]
x = self.attention_gate(x)
x = x + enriched
x = self.attention_ln(x)
# Position-wise feed-forward
x = self.positionwise_grn(x)
# Final skip connection
x = self.decoder_gate(x)
x = x + temporal_features
x = self.decoder_ln(x)
out = self.output(x)
if self.quantiles is not None:
# Reshape to [batch, time, target_size, n_quantiles]
out = out.view(out.size(0), out.size(1), self.target_size, len(self.quantiles))
else:
# Reshape to [batch, time, target_size]
out = out.view(out.size(0), out.size(1), self.target_size)
return out
class TemporalFusionTransformer(nn.Module):
"""
Implementation of https://arxiv.org/abs/1912.09363
"""
def __init__(self, config):
super().__init__()
if hasattr(config, 'model'):
config = config.model
self.encoder_length = config.encoder_length # this determines from how distant past we want to use data from
# self.embedding = LazyEmbedding(config)
self.embedding = TFTEmbedding(config)
self.static_encoder = StaticCovariateEncoder(config)
# if MAKE_CONVERT_COMPATIBLE:
self.TFTpart2 = TFTBack(config)
# else:
# self.TFTpart2 = torch.jit.script(TFTBack(config))
def forward(self, x: Dict[str, Tensor]) -> Tensor:
# Call embedding with use_target=False to skip target features entirely.
s_inp, t_known_inp, t_observed_inp, t_observed_tgt = self.embedding(x, use_target=False)
# Compute static context
cs, ce, ch, cc = self.static_encoder(s_inp)
ch, cc = ch.unsqueeze(0), cc.unsqueeze(0) # Initialize LSTM states
# Build historical inputs without teacher-forced targets.
# Include observed features if available, and the known inputs.
historical_inputs = []
if t_observed_inp is not None:
historical_inputs.append(t_observed_inp[:, :self.encoder_length, :])
historical_inputs.append(t_known_inp[:, :self.encoder_length, :])
historical_inputs = torch.cat(historical_inputs, dim=-2)
# Future inputs remain the same
future_inputs = t_known_inp[:, self.encoder_length:]
return self.TFTpart2(historical_inputs, cs, ch, cc, ce, future_inputs)
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import math
import torch
from torch import nn
class TransformerModel(nn.Module):
def __init__(self, input_dim: int,
output_dim: int,
seq_len: int,
embed_dim: int,
num_heads: int,
num_enc_layers: int):
super().__init__()
self.input_proj = nn.Linear(input_dim, embed_dim)
# Compute positional embedding ONCE at init
pe = self._get_sinusoidal_embedding(seq_len, embed_dim) # (seq_len, embed_dim)
self.register_buffer('pos_embed', pe.unsqueeze(0)) # (1, seq_len, embed_dim)
encoder_layer = nn.TransformerEncoderLayer(embed_dim, num_heads)
self.encoder = nn.TransformerEncoder(encoder_layer, num_enc_layers)
self.pool = nn.AdaptiveAvgPool1d(1)
self.head = nn.Linear(embed_dim, output_dim)
def _get_sinusoidal_embedding(self, seq_len, embed_dim):
position = torch.arange(0, seq_len).unsqueeze(1)
div_term = torch.exp(torch.arange(0, embed_dim, 2) * -(math.log(10000.0) / embed_dim))
pe = torch.zeros(seq_len, embed_dim)
pe[:, 0::2] = torch.sin(position * div_term)
pe[:, 1::2] = torch.cos(position * div_term)
return pe # (seq_len, embed_dim)
def forward(self, x):
# x: (B, seq_len, input_dim)
x = self.input_proj(x) + self.pos_embed[:, :x.size(1), :] # broadcasting
x = x.permute(1, 0, 2) # (S, B, E)
enc = self.encoder(x) # (S, B, E)
pooled = enc.mean(0) # (B, E)
return self.head(pooled)
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import os
from typing import Callable
import math
import numpy as np
from bson import ObjectId
import torch
from torch import nn
from utils.data_utils import get_collated_batch_for_key
def simple_get_y(collated_batch):
"""
Get y from collated batch
Args:
collated_batch: collated batch to get y from
Returns:
np.ndarray: y
"""
return collated_batch[1]
def simple_model_save(model: nn.Module,
training_configuration: dict) -> None:
"""
Save model to disk
Args:
model: model to save
training_configuration: training configuration
Returns:
None
"""
model_path = os.path.join(training_configuration["training_dir"], "model.pt")
torch.save(model.state_dict(), model_path)
def simple_model_load(model_configuration: dict,
training_configuration: dict,
sample_key: str | ObjectId,
device: str,
model_creation_fn: Callable,
*args, **kwargs) -> nn.Module:
"""
Load model from disk
Args:
model_configuration: model configuration
training_configuration: training configuration
sample_key: sample key to get sample data batch with
device: device to load model on
model_creation_fn: function to create model
Returns:
model: loaded model
"""
training_dir = training_configuration["training_dir"]
model_state_path = os.path.join(training_dir, "model.pt")
model = model_creation_fn(model_configuration,
sample_key, *args, **kwargs)
model.to(device)
model.load_state_dict(torch.load(model_state_path))
return model
def simple_model_creation(model_configuration: dict,
sample_key: str | ObjectId,
lmdb_env=None) -> nn.Module:
"""
Create model from configuration
Args:
model_configuration: model configuration
sample_key: sample key to get sample data batch with
lmdb_env: LMDB environment to use for getting sample data batch
Returns:
model: created model
"""
sample_item = get_collated_batch_for_key(sample_key, model_configuration, lmdb_env=lmdb_env)
input_size = sample_item[0].shape[2]
output_size = sample_item[1].shape[2]
model_class = model_configuration["model_class"]
cnn_model = model_class(input_dim=input_size,
output_dim=output_size,
**model_configuration["model_parameters"], )
return cnn_model
def simple_x_y_predict(model: nn.Module,
collated_batch: tuple[torch.Tensor, torch.Tensor],
device: str,
batch_size: int,
*args, **kwargs) -> torch.Tensor:
"""
Predict y from x
Args:
model: model to use for prediction, must have 'predict' method
collated_batch: collated data batch to predict with,
must be a tuple of (x, y) where x is the input data and y is the target data
device: device to use for prediction
*args: additional arguments to pass to the model's predict method
**kwargs: additional keyword arguments to pass to the model's predict method
Returns:
torch.Tensor: predicted y as numpy array on CPU
"""
model.eval()
x = collated_batch[0].to(device).float()
batches = list()
num_batches = math.ceil(len(x) / batch_size)
for i in range(num_batches):
start = i * batch_size
end = (i + 1) * batch_size
if end > len(x):
end = len(x)
batch_slice = x[start:end]
batches.append(batch_slice)
preds = list()
with torch.no_grad():
for batch in batches:
batch = batch.to(device).float()
pred = model(batch, *args, **kwargs)
preds.append(pred.cpu().numpy())
return np.concatenate(preds)
def simple_get_y(collated_batch: tuple[torch.Tensor, torch.Tensor], ) -> torch.Tensor:
"""
Get y from collated batch
Args:
collated_batch: collated batch to get y from
Returns:
torch.Tensor: y
"""
return collated_batch[1]
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import json
import sys
import os
import argparse
import logging
from datetime import datetime
import lmdb
import dotenv
import torch
from torch.utils.data import DataLoader
import torch.distributed as dist
from experiment_setup import get_eval_functions
from utils.evaluation import evaluate_model
from utils.model_utils import get_model_config
from utils.training_utils import get_training_config, get_data_ids
from utils.data_utils import LMDBIterableDataset
from utils.utils import get_variable_from_module, get_logger, convert_for_json
from utils.training import train_model
dotenv.load_dotenv()
logger = None
# set up distributed training
dist.init_process_group(backend="nccl", init_method="env://")
local_rank = torch.distributed.get_rank()
torch.cuda.set_device(local_rank)
def prepare_run(results_dir: str,
lmdb_root_dir: str,
base_model_configuration: dict,
base_training_configuration: dict):
# create model configuration from base
logger.info("Creating model configuration")
model_configuration = get_model_config(base_model_configuration, results_dir, lmdb_root_dir)
feature_config = model_configuration["feature_config"]
dataset_dir = f"{lmdb_root_dir}/{feature_config['feature_set_name']}"
logger.info(f"Model configuration name: {model_configuration['id']}")
# create training configuration
logger.info("Creating training configuration")
training_configuration = get_training_config(base_training_configuration, model_configuration)
logger.info(f"Training configuration: {training_configuration['id']}")
logger.info(f"Fetching data ids, limit: {item_limit}")
train_ids, val_ids, test_ids = get_data_ids(model_configuration, training_configuration, dataset_dir, item_limit)
logger.info(f"Train ids: {len(train_ids)}, Val ids: {len(val_ids)}, Test ids: {len(test_ids)}")
return model_configuration, training_configuration, train_ids, val_ids, test_ids, dataset_dir
def train(
model_configuration: dict,
training_configuration: dict,
train_ids: list,
val_ids: list,
dataset_dir: str,
log_dir: str) -> None:
# create training and validation loaders
logger.info("Creating training loaders")
train_loader = LMDBIterableDataset(dataset_dir,
train_ids,
model_configuration=model_configuration,
batch_size=training_configuration["batch_size"])
logger.info("Creating validation loaders")
val_loader = LMDBIterableDataset(dataset_dir,
val_ids,
model_configuration=model_configuration,
batch_size=training_configuration["batch_size"])
# instantiate model
logger.info("Creating model")
lmdb_env = lmdb.open(dataset_dir, readonly=True)
model_creation_fn = model_configuration["model_creation_fn"]
model = model_creation_fn(model_configuration,
train_ids[0],
lmdb_env=lmdb_env)
logger.info(f"Started training for model {model_configuration['id']}")
train_model(
model=model,
model_configuration=model_configuration,
training_configuration=training_configuration,
train_dataset=train_loader,
val_dataset=val_loader,
log_dir=log_dir,
logger=logger
)
def evaluate(model_configuration: dict,
training_configuration: dict,
test_ids: list,
device) -> dict:
logger.info(f"Evaluating model {model_configuration['id']}")
eval_functions = get_eval_functions(model_configuration)
results = evaluate_model(model_configuration,
training_configuration,
test_ids,
eval_functions)
# save results to file
results_dir = training_configuration["training_dir"]
if not os.path.exists(results_dir):
os.makedirs(results_dir)
results_file = os.path.join(results_dir, "evaluation_results.json")
with open(results_file, "w") as f:
json.dump(convert_for_json(results), f, indent=4)
return results
if __name__ == "__main__":
parser = argparse.ArgumentParser(description="Training wrapper for model training")
parser.add_argument("run_configuration_module",
type=str,
help="Path to the run configuration module")
parser.add_argument("--run_configuration_variable",
type=str,
required=False,
default="run_configuration",
help="Name of the run configuration variable in the module")
parser.add_argument("--results_dir",
type=str,
required=False,
default=None,
help="Directory to save the results")
parser.add_argument("--lmdb_root_dir",
type=str,
required=False,
default=None,
help="Path to the lmdb directory")
parser.add_argument("--log_dir",
type=str,
required=False,
default=None,
help="Directory to save the logs")
parser.add_argument("--item_limit",
type=int,
required=False,
default=None,
help="Limit the number of items to process, default is None (no limit)")
parser.add_argument("--device",
type=str,
required=False,
default="cuda",
help="Device to use for training, default is cuda")
args = parser.parse_args()
# load run configuration from module
run_configuration = get_variable_from_module(
# make sure to replace / with . and remove .py to get proper module tree
module_path=args.run_configuration_module.replace(".py", "").replace("/", "."),
variable_name=args.run_configuration_variable)
# check for variables in run_configuration
if not args.results_dir:
if "base_results_dir" not in run_configuration:
results_dir = os.getenv("RESULTS_ROOT_DIR")
else:
results_dir = run_configuration["base_results_dir"]
else:
results_dir = args.results_dir
if results_dir is None:
raise ValueError(
"No results directory specified. Please set the RESULTS_ROOT_DIR environment variable or provide a results_dir argument.")
if not os.path.exists(results_dir):
os.makedirs(results_dir)
if not args.lmdb_root_dir:
if "base_lmdb_root_dir" not in run_configuration:
lmdb_root_dir = os.getenv("LMDB_ROOT_DIR")
else:
lmdb_root_dir = run_configuration["base_lmdb_root_dir"]
else:
lmdb_root_dir = args.lmdb_root_dir
if lmdb_root_dir is None:
raise ValueError(
"No LMDB root directory specified. Please set the LMDB_ROOT_DIR environment variable or provide a lmdb_root_dir argument.")
if not os.path.exists(lmdb_root_dir):
os.makedirs(lmdb_root_dir)
if not args.log_dir:
if "base_log_dir" not in run_configuration:
log_dir = os.getenv("LOG_DIR")
else:
log_dir = run_configuration["log_dir"]
else:
log_dir = args.log_dir
if log_dir is None:
raise ValueError(
"No log directory specified. Please set the LOG_DIR environment variable or provide a log_dir argument.")
if not os.path.exists(log_dir):
os.makedirs(log_dir)
item_limit = args.item_limit if args.item_limit else run_configuration["item_limit"]
if item_limit == -1:
item_limit = None
run_name = run_configuration["name"]
runs = run_configuration["runs"]
# set up run_id on rank 0
if local_rank == 0:
run_id = f"{run_name}_{datetime.now().strftime('%Y%m%d_%H%M%S')}"
else:
run_id = None
# broadcast run_id to all processes
if dist.is_initialized():
run_id_list = [run_id]
torch.distributed.broadcast_object_list(run_id_list, src=0)
run_id = run_id_list[0]
# make sure run_id is a string
run_id = str(run_id)
# append run_id to results_dir and log_dir
results_dir = os.path.join(results_dir, run_id)
log_dir = os.path.join(log_dir, run_id)
# create directories if they do not exist, only on the main process
if torch.distributed.get_rank() == 0 or not dist.is_initialized():
if not os.path.exists(results_dir):
os.makedirs(results_dir)
if not os.path.exists(log_dir):
os.makedirs(log_dir)
# set up logger
logger = get_logger(module_name=run_name, filename=os.path.join(log_dir, "main.log"))
logger.info(f"Rank {local_rank}: Starting run {run_name}")
logger.info(f"Rank {local_rank}: Run ID: {run_id}")
# print parameter values
logger.info(f"Rank {local_rank}: Results directory: {results_dir}")
logger.info(f"Rank {local_rank}: LMDB root directory: {lmdb_root_dir}")
logger.info(f"Rank {local_rank}: Log directory: {log_dir}")
logger.info(f"Rank {local_rank}: Item limit: {item_limit}")
if not runs or len(runs) == 0:
raise ValueError("No runs specified in the run configuration. Please provide a list of runs to train.")
try:
for run in runs:
run_step_name = run["name"]
run_description = run["description"]
run_model_configuration = run["model_configuration"]
run_training_configuration = run["training_configuration"]
logger.info(f"Rank {local_rank}: Running: {run_step_name}")
logger.info(f"Rank {local_rank}: Description: {run_description}")
# prepare run, make sure rank 0 is the first to avoid race conditions
if local_rank == 0:
logger.info(f"Rank {local_rank}: Preparing run {run_step_name}")
run_model_configuration, run_training_configuration, train_ids, val_ids, test_ids, dataset_dir = prepare_run(
results_dir=results_dir,
lmdb_root_dir=lmdb_root_dir,
base_model_configuration=run_model_configuration,
base_training_configuration=run_training_configuration
)
logger.info(f"Rank {local_rank}: Finished preparing run {run_step_name}")
# sync after preparing run
if dist.is_initialized():
dist.barrier()
else:
# wait for rank 0 to finish preparing run
if dist.is_initialized():
dist.barrier()
logger.info(f"Rank {local_rank}: Waiting for rank 0 to finish preparing run {run_step_name}")
run_model_configuration, run_training_configuration, train_ids, val_ids, test_ids, dataset_dir = prepare_run(
results_dir=results_dir,
lmdb_root_dir=lmdb_root_dir,
base_model_configuration=run_model_configuration,
base_training_configuration=run_training_configuration
)
train(
model_configuration=run_model_configuration,
training_configuration=run_training_configuration,
train_ids=train_ids,
val_ids=val_ids,
dataset_dir=dataset_dir,
log_dir=log_dir,
)
# sync after training
if dist.is_initialized():
dist.barrier()
logger.info(f"Rank {torch.distributed.get_rank()} finished training {run_step_name}")
# run evaluation, only on rank 0
local_rank = torch.distributed.get_rank()
if local_rank == 0:
logger.info(f"Rank {local_rank} starting evaluation for {run_step_name}")
results = evaluate(
model_configuration=run_model_configuration,
training_configuration=run_training_configuration,
test_ids=test_ids,
)
logger.info(
f"Rank {local_rank} finished evaluation for {run_step_name} with model {run_model_configuration['id']}")
logger.info(f"Results: {results}")
# sync after evaluation
if dist.is_initialized():
dist.barrier()
finally:
# clean up
if dist.is_initialized():
dist.destroy_process_group()
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import copy
import logging
import os
import random
import lmdb
import numpy as np
from bson import ObjectId
from torch.utils.data import IterableDataset
from tqdm import tqdm
from utils.dataset_creation import get_features, load_scalers, scale_item, combine_features
from utils.dataset_utils import load_key_stats
from utils.lmdb_utils import load_from_lmdb
from vsm_datascience_common.cycle_database_connection.cycle_data import get_cycle_by_id
from vsm_datascience_common.cycle_database_connection.db_utils import get_cycles_collection
logger = logging.getLogger(__name__)
def get_prepared_sequence_length(input_sequence: np.ndarray, model_configuration: dict) -> int:
"""
Returns the length of the input sequence after padding and resampling
"""
initial_length = len(input_sequence)
take_every_nth = model_configuration["preprocessing"]["take_every_nth"]
padding_length = get_padding_length(model_configuration, resampled=False)
raw_length = initial_length + padding_length
adjusted = int(raw_length // take_every_nth)
return adjusted
def get_padding_length(model_configuration: dict, resampled: bool = True) -> int:
"""
Returns the length of the input sequence after padding and resampling
"""
take_every_nth = model_configuration["preprocessing"]["take_every_nth"]
padding_length = int(model_configuration["input_window_length"] * (
1 - model_configuration["preprocessing"]["min_input_length_fraction_for_padding"])) * (
take_every_nth if not resampled else 1)
return padding_length
def get_number_of_windows(base_length: int, model_configuration: dict) -> int:
"""
Returns the number of windows for a given sequence length
"""
window_shift = model_configuration["preprocessing"]["window_shift"]
input_window_length = model_configuration["input_window_length"]
output_window_length = model_configuration["output_window_length"]
output_window_offset = model_configuration["output_window_offset"]
if input_window_length > output_window_length + output_window_offset:
return (base_length - input_window_length) // window_shift + 1
else:
return (base_length - output_window_length - output_window_offset) // window_shift + 1
def get_collated_batch_for_key(sample_key: ObjectId | str,
model_configuration: dict,
start_cutoff: int = None,
end_cutoff: int = None,
lmdb_env=None) -> dict:
sample_batch_for_key = get_batch_for_key(sample_key, model_configuration,
start_cutoff=start_cutoff,
end_cutoff=end_cutoff,
lmdb_env=lmdb_env)
collated = model_configuration["collate_fn"](sample_batch_for_key)
return collated
def get_batch_for_key(key,
model_configuration: dict,
start_cutoff: int = None,
end_cutoff: int = None,
lmdb_env=None) -> np.ndarray:
"""
Get the batch for a given key from the lmdb database or compute it directly.
The return has the same format as the batch produced by the batch_fn in the model configuration.
Args:
key: key to get the batch for, can also be object id from database
model_configuration: model configuration to use
start_cutoff: start cutoff for the batch, if None, the whole batch is used, CAUTION: cutoff should not be normalized -> in raw data points
end_cutoff: end cutoff for the batch, if None, the whole batch is used, CAUTION: cutoff should not be normalized -> in raw data points
lmdb_env: the lmdb environment to use, if None, the features are computed directly from the database
Returns:
batch: batch for the given key, as returned by the batch_fn in the model configuration
"""
if lmdb_env is None:
# compute and scale features, ignored features are handled internally
features = get_scaled_feature_for_key(key, model_configuration)
else:
# load features from lmdb
features = load_from_lmdb(lmdb_env, str(key))
# ignored features are handled internally, thus we need to remove them here
ignored_features = model_configuration["feature_config"]["ignored_features"] if "ignored_features" in \
model_configuration[
"feature_config"] else []
# add scaled versions of features
ignored_features = ignored_features + [feat + "_scaled" for feat in ignored_features]
for feature_set in features:
for feature_name in list(features[feature_set].keys()):
if feature_name in ignored_features:
del features[feature_set][feature_name]
processed_chunk = process_chunk([key], [features], model_configuration)
# use cutoff, if provided
if start_cutoff is not None or end_cutoff is not None:
item_length = len(processed_chunk[0]["target_features"])
if start_cutoff is None:
start_cutoff = 0
if end_cutoff is None:
end_cutoff = item_length
# "normalize" cutoff to adjust for added padding and resampling
padding_length = get_padding_length(model_configuration, resampled=False)
take_every_nth = model_configuration["preprocessing"]["take_every_nth"]
# make sure that there is no padding added to the start cutoff, so that it includes the padding added to the sequence
start_cutoff_normalized = max(int(start_cutoff // take_every_nth), 0)
# end cutoff must be adjusted to include the padding added to the sequence
end_cutoff_normalized = min(int((end_cutoff + padding_length) // take_every_nth), item_length)
for feature_set in processed_chunk[0]:
if feature_set in model_configuration["feature_config"]["feature_sets"]:
processed_chunk[0][feature_set] = processed_chunk[0][feature_set][
start_cutoff_normalized:end_cutoff_normalized + 1]
if "batch_fn" in model_configuration and model_configuration["batch_fn"] is not None:
batch = model_configuration["batch_fn"](processed_chunk, model_configuration)
else:
batch = processed_chunk
if batch is None or len(batch) == 0:
raise ValueError(f"Batch is empty for key {key}")
return batch
def get_scaled_feature_for_key(key: str,
model_configuration: dict) -> tuple:
feature_config = model_configuration["feature_config"]
user_cycles = list(
get_cycles_collection().find({"user_id": ObjectId(key)} | feature_config["filter_criteria"]).sort("starts_at",
1))
cycle_features = list()
for cycle in user_cycles:
features = get_features(cycle, feature_config)
cycle_features.append(features)
# combine all cycles for the user
if len(cycle_features) == 0:
raise ValueError(f"No features found for key {key}")
features = combine_features(cycle_features, feature_config)
scaler_dir = os.path.join(feature_config["dataset_dir"], "scalers")
scalers = load_scalers(scaler_dir)
# scale features
scaled_features = scale_item(features, scalers)
return scaled_features
def augment_items(identifiers: list,
items: list[dict],
feature_config: dict,
lmdb_env: lmdb.Environment = None) -> list:
"""
Augments the given sequences by attaching previous sequences
Args:
identifiers: identifiers of items for finding previous sequences
items: actual items
feature_config: feature config of the dataset
lmdb_env: lmdb environment for loading previous sequences, can be None, in this case the items are computed directly
Returns:
list of augmented items
"""
if "augmentation" not in feature_config or \
feature_config["augmentation"]["use_augmentation"] is False:
return items
augmented_items = list()
for i, item in enumerate(items):
item_id = identifiers[i]
try:
item_data = get_cycles_collection().find_one({"_id": ObjectId(item_id)}, {"user_id": 1, "starts_at": 1})
item_user_id = item_data["user_id"]
item_starts_at = item_data["starts_at"]
except KeyError:
print(f"User ID not found for item {item_id}")
continue
previous_item_identifiers = list(get_cycles_collection().aggregate(
# make sure to filter by user first to significantly reduce the number of items
[
{
"$match": {
"user_id": item_user_id,
"starts_at": {"$lt": item_starts_at},
}
}
] + feature_config["filter_criteria_pipeline"] + [
{
"$sort": {
"starts_at": -1
}
},
{
"$project": {
"_id": 1,
"starts_at": 1
}
}
]
))
max_lookback = feature_config["augmentation"]["max_lookback"]
previous_items = list()
for previous_item in previous_item_identifiers:
if len(previous_items) >= max_lookback:
break
previous_item_id = previous_item["_id"]
if lmdb_env is None:
# compute item
cycle = get_cycle_by_id(previous_item_id)
features = get_features(cycle, feature_config)
scaler_dir = os.path.join(feature_config["dataset_dir"], "scalers")
scalers = load_scalers(scaler_dir)
previous_item = scale_item(features, scalers)
previous_items.append(previous_item)
else:
# take item from lmdb
try:
# make sure to parse object id
previous_item = load_from_lmdb(lmdb_env, str(previous_item_id))
except KeyError:
continue
previous_items.append(previous_item)
# merge items into one
feature_sets = feature_config["feature_sets"]
augmented_item = copy.deepcopy(item)
for feature_set in feature_sets:
if feature_set not in augmented_item:
continue
if "static" in feature_set:
continue
for feature_name in augmented_item[feature_set]:
if feature_name not in augmented_item[feature_set]:
continue
augmented_item[feature_set][feature_name] = np.concatenate(
[previous_item[feature_set][feature_name] for previous_item in previous_items]
+ [augmented_item[feature_set][feature_name]])
augmented_items.append(augmented_item)
return augmented_items
def process_chunk(ids: list,
chunk: list,
model_configuration: dict,
ignored_features: list = None,
pad_sequences: bool = True,
statics_as_list: bool = True):
"""
Creates a chunk of data as dataframe for training and inference of a tft model.
:param ids: list of ids of the data points in the chunk
:param chunk: list of data points
:return: dataframe with the data points in the chunk
"""
if ignored_features is None:
ignored_features = list()
input_features = list(chunk[0]["target_features"].keys())
feature_config = model_configuration["feature_config"]
# variables for padding
padding_value = 0
# create dataframe from items in chunk
data = []
for i, item in enumerate(chunk):
item_length = item["target_features"][input_features[0]].shape[0]
take_every_nth = model_configuration["preprocessing"]["take_every_nth"]
data_item = dict()
for feature_set in feature_config["feature_sets"]:
if feature_set in item and len(item[feature_set]) > 0:
# fill in the data
source = item[feature_set]
features_to_use = [feature for feature in source.keys() if "_scaled" in feature]
feature_set_data = [source[feature] for feature in features_to_use]
padding_length = get_padding_length(model_configuration, resampled=False)
if len(feature_set_data) == 0:
raise ValueError(f"No features found for key {ids[i]} in feature set {feature_set}")
if len(feature_set_data[0]) == 1:
# if the feature is constant, we need to repeat it for all time points
if statics_as_list:
if pad_sequences:
desired_length = item_length + padding_length
feature_set_data = np.array(
[np.full((desired_length,), val) for val in feature_set_data]).T[::take_every_nth]
else:
feature_set_data = np.array(
[np.full((item_length,), val) for val in feature_set_data]).T[::take_every_nth]
else:
feature_set_data = np.array(feature_set_data).flatten()
else:
if pad_sequences:
padding_values = np.full((padding_length, len(feature_set_data)),
[padding_value for vals in feature_set_data]).T
feature_set_data = np.concatenate([padding_values, np.array(feature_set_data)], axis=1)
# create bins of n values and apply mean
# check, if special accumulation function has been specified
individual_feature_data = list()
for i, feature_to_use in enumerate(features_to_use):
try:
# get config for feature, make sure to replace scaled to get actual config
current_feature_config = \
[x for x in feature_config[feature_set] if
x["name"] == feature_to_use.replace("_scaled", "")][0]
current_accumulation_fn = current_feature_config["accumulation_fn"]
except (KeyError, IndexError):
# default to mean
current_accumulation_fn = np.mean
current_feature_data = apply_fn_to_bins(feature_set_data[i], take_every_nth,
current_accumulation_fn)
individual_feature_data.append(current_feature_data)
# stack individual features
feature_set_data = np.stack(individual_feature_data).T
if feature_set not in data_item:
data_item[feature_set] = feature_set_data
else:
data_item[feature_set] = np.concatenate([data_item[feature_set], feature_set_data], axis=1)
data.append(data_item)
return data
def apply_fn_to_bins(input_sequence: np.ndarray,
bin_size: int,
fn: callable) -> np.ndarray:
"""
Applies a function to the bins of the input sequence along the last dimension and returns the results.
Args:
input_sequence: sequence to apply the function to (1D or 2D)
bin_size: size of the bins
fn: function to apply to the bins
Returns:
np.ndarray: result of the function applied to the bins
"""
if input_sequence.ndim == 1:
input_sequence = input_sequence.reshape(1, -1)
dims = 1
else:
dims = input_sequence.shape[-1]
result = []
for row in input_sequence:
row_result = []
for start in range(0, len(row), bin_size):
end = min(start + bin_size, len(row))
bin_slice = row[start:end]
row_result.append(fn(bin_slice))
result.append(row_result)
if dims > 1:
return np.array(result)
else:
return np.array(result[0])
def produce_window_batches(data_chunk: list,
model_configuration: dict,
offsets: list | np.ndarray = None) -> list:
"""
Produces batches of windows from the data chunk.
Args:
data_chunk: data chunk
model_configuration: configuration to use
offsets: offsets used to determine the length of data to use, uses item[-offset:] of data
Returns:
data: list of windows
"""
input_window_length = model_configuration["input_window_length"]
output_window_length = model_configuration["output_window_length"]
output_window_offset = model_configuration["output_window_offset"]
window_shift = model_configuration["preprocessing"]["window_shift"]
if offsets is None:
offsets = np.zeros(len(data_chunk), dtype=int)
data = list()
for i, item in enumerate(data_chunk):
item_length = item["target_features"][-offsets[i]:].shape[0]
total_window_length = input_window_length if input_window_length > output_window_length + output_window_offset \
else output_window_length + output_window_offset
if item_length < total_window_length:
continue
# number of windows is defined by the input window length and output window length with offset
num_windows = get_number_of_windows(item_length, model_configuration)
for j in range(num_windows):
window = dict()
for key, value in item.items():
if value is None:
window[key] = None
else:
if key == "target_features":
window[key] = value[-offsets[i]:][j * window_shift + output_window_offset:
j * window_shift + output_window_length + output_window_offset]
else:
window[key] = value[-offsets[i]:][j * window_shift:j * window_shift + input_window_length]
data.append(window)
return data
def produce_simple_batches(data_chunk: list,
model_configuration: dict,
offsets: list | np.ndarray = None) -> list:
"""
Produces batches without windowing.
Args:
data_chunk: data chunk
model_configuration: configuration to use
offsets: offsets used to determine the length of data to use, uses item[-offset:] of data
Returns:
data: list of items
"""
pass
class LMDBIterableDataset(IterableDataset):
def __init__(self,
lmdb_env_path: str,
lmdb_keys: list[str],
model_configuration: dict,
batch_size: int = 32):
self.lmdb_path = lmdb_env_path
self.lmdb_env = None
self.lmdb_keys = lmdb_keys
self.key_subset = None
self.model_configuration = model_configuration
self.batch_size = batch_size
self.keys_stats = load_key_stats(model_configuration["feature_config"]["dataset_dir"])
self.len = None
try:
self.model_configuration["batch_fn"]
except KeyError:
raise KeyError("Batch function not found in model configuration")
def set_key_subset(self, key_subset: list[str]):
"""
Set the key subset to use for the dataset.
Args:
key_subset: list of keys to use
"""
self.key_subset = key_subset
# reset length
self.len = None
def get_length_of_data_subset(self, key_set: list[str]):
"""
Get the length of the data subset.
Args:
key_set: list of keys to use
"""
# run simplified version of __iter__ to get the length
num_steps = 0
i = 0
num_batch_items = 0
while True:
if num_batch_items >= self.batch_size:
num_steps += 1
num_batch_items -= self.batch_size
else:
if i >= len(key_set):
if num_batch_items > 0:
num_steps += 1
break
key = key_set[i]
i += 1
# try to fetch stats from key_stats
try:
current_key_stats = self.keys_stats["by_key"][key]
base_length = current_key_stats["item_length"]
take_every_nth = self.model_configuration["preprocessing"]["take_every_nth"]
padding_length = get_padding_length(self.model_configuration, resampled=False)
raw_length = base_length + padding_length
item_length = int(raw_length // take_every_nth)
except:
item = load_from_lmdb(self.lmdb_env, key)
item_length = get_prepared_sequence_length(
item["target_features"][list(item["target_features"])[0]],
self.model_configuration)
num_windows = get_number_of_windows(item_length, self.model_configuration)
num_batch_items += num_windows
return num_steps
def __iter__(self):
self.init_lmdb_env()
# if no key subset is set, use all keys
if self.key_subset is None:
self.key_subset = self.lmdb_keys
random.shuffle(self.key_subset)
batch = list()
counter = 0
collate_fn = self.model_configuration["collate_fn"]
while True:
if len(batch) >= self.batch_size:
if collate_fn is None:
yield batch[:self.batch_size]
else:
yield collate_fn(batch[:self.batch_size])
batch = batch[self.batch_size:]
else:
if counter >= len(self.key_subset):
if len(batch) > 0:
yield collate_fn(batch)
break
key = self.lmdb_keys[counter]
counter += 1
try:
current_batch = get_batch_for_key(key, self.model_configuration, lmdb_env=self.lmdb_env)
except ValueError:
# if betch is empty, try next
continue
batch.extend(current_batch)
def init_lmdb_env(self):
if self.lmdb_env is None:
self.lmdb_env = lmdb.open(self.lmdb_path,
readonly=True,
lock=False,
readahead=False,
meminit=False)
def __len__(self):
self.init_lmdb_env()
# if no key subset is set, use all keys
if self.key_subset is None:
self.key_subset = self.lmdb_keys
if self.len is None:
num_steps = self.get_length_of_data_subset(self.key_subset)
self.len = num_steps
return self.len
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import os
import lmdb
import numpy as np
import pandas as pd
import torch
from sklearn.preprocessing import StandardScaler, MinMaxScaler
import joblib
from utils.lmdb_utils import load_from_lmdb, get_lmdb_keys
def get_features(cycle: dict,
feature_config: dict) -> dict:
"""
Computes the feature for a given cycle defined by the feature_config
:param cycle: cycle data as dictionary
:param feature_config: feature config as dictionary
:return: dict with feature according feature config
"""
features = {}
feature_sets = feature_config["feature_sets"]
for feature_set in feature_sets:
for feature_def in feature_config[feature_set]:
if feature_set not in features:
features[feature_set] = {}
# skip features that are marked as ignored
if "ignored_features" in feature_config and feature_def["name"] in feature_config["ignored_features"]:
continue
feature_return = feature_def["fn"](cycle=cycle)
if isinstance(feature_return, dict):
if len(feature_return) > 1:
for feature_name, feature in feature_return.items():
features[feature_set][f"{feature_def['name']}_{feature_name}"] = feature
else:
features[feature_set][feature_def["name"]] = list(feature_return.values())[0]
else:
features[feature_set][feature_def["name"]] = feature_return
# check, if all features have same length
if feature_set in features and len(features[feature_set]) > 0 and isinstance(
list(features[feature_set].values())[0], np.ndarray):
feature_lengths = [len(x) for x in features[feature_set].values()]
if len(set(feature_lengths)) > 1:
raise ValueError(f"Feature set {feature_set} has features of different lengths: {feature_lengths}")
return features
def save_scalers(scalers: dict,
scaler_dir: str):
if not os.path.exists(scaler_dir):
os.makedirs(scaler_dir)
for feature_type in scalers:
for feature_name in scalers[feature_type]:
joblib.dump(scalers[feature_type][feature_name],
f"{scaler_dir}/{feature_name}.pkl")
def load_scalers(scaler_dir: str) -> dict:
scalers = dict()
for scaler_file in os.listdir(scaler_dir):
if scaler_file.endswith(".pkl"):
feature_name = scaler_file.replace(".pkl", "")
scalers[feature_name] = joblib.load(f"{scaler_dir}/{scaler_file}")
return scalers
def get_scalers_for_model(model_configuration: dict):
"""
Get the scalers for the features of a model configuration
Args:
model_configuration: configuration of the model
Returns:
scalers: scalers for the model
"""
scaler_dir = os.path.join(model_configuration["feature_config"]["dataset_dir"], "scalers")
scalers = load_scalers(scaler_dir)
return scalers
def get_feature_values(feature_type: str | None,
feature_name: str,
env: lmdb.Environment,
keys: list = None) -> list:
"""
Get the values of a feature from the lmdb dataset for all keys
:param feature_type: type of feature, can be None, then the first feature with the given name will be used
:param feature_name: feature name to extract
:param env: lmdb environment
:param keys: keys to extract the feature from, if None, all keys will be used / fetched from the database
:return: list with feature values
"""
if keys is None:
keys = get_lmdb_keys(env)
feature_values = []
for key in keys:
data = load_from_lmdb(env, key)
if feature_type is None:
for feature_type, feature_data in data.items():
if feature_name in feature_data:
feature_values.append(feature_data[feature_name])
break
else:
for current_feature_name, feature_data in data[feature_type].items():
# catch sub features that have been prefixed with the feature name
if current_feature_name.startswith(feature_name):
feature_values.append(feature_data)
break
return feature_values
def train_scalers(feature_type: str,
feature_name: str,
scaler_type,
sample,
env) -> dict:
scalers = dict()
all_features = sample[feature_type]
individual_feature_names = list()
for individual_feature_name in all_features:
if individual_feature_name.startswith(feature_name) and not individual_feature_name.endswith("_scaled"):
individual_feature_names.append(individual_feature_name)
for individual_feature_name in individual_feature_names:
feature_values = get_feature_values(feature_type, individual_feature_name, env)
if len(feature_values) == 0:
raise ValueError(f"No feature values found for feature {individual_feature_name}")
if isinstance(feature_values[0], list) or isinstance(feature_values[0], np.ndarray):
features_reshaped = np.concatenate(feature_values).reshape(-1, 1)
else:
features_reshaped = np.array(feature_values).reshape(-1, 1)
del feature_values
if scaler_type is not None:
scaler = scaler_type()
scaler.fit(features_reshaped)
else:
scaler = None
scalers[individual_feature_name] = scaler
return scalers
def scale_item(data: dict,
scalers: dict):
data_format = dict()
for feature_set in data:
if feature_set not in data_format:
data_format[feature_set] = dict()
for feature_name in data[feature_set]:
if feature_name.endswith("_scaled"):
continue
data_format[feature_set][feature_name] = data[feature_set][feature_name]
for feature_set in data_format:
for feature_name in data_format[feature_set]:
feature_values = data[feature_set][feature_name]
if scalers[feature_name] is not None:
if isinstance(feature_values, list) or isinstance(feature_values, np.ndarray):
scaled_feature_values = scalers[feature_name].transform(
feature_values.reshape(-1, 1)).flatten()
else:
scaled_feature_values = scalers[feature_name].transform(
np.array(feature_values).reshape(-1, 1)).flatten()
else:
scaled_feature_values = feature_values
data[feature_set][f"{feature_name}_scaled"] = scaled_feature_values
return data
def inverse_scale_feature(input_feature: np.ndarray | int | float | torch.Tensor,
feature_names: np.ndarray | list | str,
scalers: dict) -> np.ndarray:
"""
Inverse scales the input features, can handle single and multi feature input
Args:
input_feature: input feature as a numpy array
feature_names: names of input features as reference for scalers
scalers: dict of feature scalers
Returns:
scaled input features as numpy array
"""
if isinstance(feature_names, str):
feature_names = [feature_names]
if isinstance(input_feature, np.ndarray) or isinstance(input_feature, torch.Tensor):
input_dim = input_feature.shape[1] if len(input_feature.shape) > 1 else 1
elif isinstance(input_feature, float) or isinstance(input_feature, int):
# handle case, where input is scalar
input_scaled = scalers[feature_names[0]].inverse_transform([[input_feature]])[0][0]
return input_scaled
elif isinstance(input_feature, list):
input_feature = np.array(input_feature)
input_dim = input_feature.shape[1] if len(input_feature.shape) > 1 else 1
else:
raise ValueError(f"Unsupported input type: {type(input_feature)}")
# reshape, if input is one dimensional
if input_dim == 1:
input_feature = input_feature.reshape(-1, 1)
input_scaled = input_feature.copy()
for i in range(input_dim):
input_scaled[:, i] = scalers[feature_names[i]].inverse_transform(np.array([input_scaled[:, i]]))
return input_scaled
def combine_features(cycles: list[dict], feature_config: dict) -> dict:
combined_features = dict()
for feature_set in feature_config["feature_sets"]:
combined_features[feature_set] = dict()
if feature_set not in cycles[0]:
continue
features_in_set = cycles[0][feature_set].keys()
for feature in features_in_set:
feature_values = [cycles[i][feature_set][feature] for i in range(len(cycles))]
if isinstance(feature_values[0], dict):
for key in feature_values[0].keys():
feature_array = np.concatenate([feature_values[i][key] for i in range(len(feature_values))])
combined_features[feature_set][key] = feature_array
else:
feature_array = np.concatenate(feature_values)
combined_features[feature_set][feature] = feature_array
return combined_features
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import os
import pickle
def get_dataset_path(lmdb_base_dir: str,
dataset_name: str) -> str:
"""
Get the path to the dataset in the lmdb directory
Args:
lmdb_base_dir: base directory of the lmdb dataset
dataset_name: name of the dataset
Returns:
path to the dataset
"""
dataset_path = os.path.join(lmdb_base_dir, dataset_name)
if not os.path.exists(dataset_path):
raise FileNotFoundError(f"Dataset {dataset_name} not found in {lmdb_base_dir}")
return dataset_path
def load_key_stats(lmdb_dir: str) -> dict:
"""
Load key statistics from the LMDB database.
:param lmdb_dir: Directory of the LMDB database.
:return: Dictionary with statistics.
"""
key_stats_path = f"{lmdb_dir}/key_stats.pickle"
if not os.path.exists(key_stats_path):
return dict()
with open(key_stats_path, "rb") as f:
key_stats = pickle.load(f)
return key_stats
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import lmdb
import numpy as np
import sklearn
import torch
from torch import nn
from tqdm import tqdm
from utils.data_utils import get_collated_batch_for_key, get_padding_length
from utils.dataset_creation import get_scalers_for_model, inverse_scale_feature
from utils.dataset_utils import load_key_stats
from vsm_datascience_common import constants
def evaluate_model(model_configuration: dict,
training_configuration: dict,
test_ids: list,
evaluation_functions: list) -> dict:
dataset_dir = model_configuration["feature_config"]["dataset_dir"]
lmdb_env = lmdb.open(dataset_dir, readonly=True)
# get computation rank
if torch.distributed.is_initialized():
local_rank = torch.distributed.get_rank()
torch.cuda.set_device(local_rank)
device = torch.device(f"cuda:{local_rank}")
else:
device = torch.device("cuda" if torch.cuda.is_available() else "cpu")
load_fn = model_configuration["model_load_fn"]
model = load_fn(model_configuration=model_configuration,
training_configuration=training_configuration,
sample_key=test_ids[0],
device=device,
lmdb_env=lmdb_env)
# load key stats to retrieve individual cycles
keys_stats = load_key_stats(model_configuration["feature_config"]["dataset_dir"])
batch_size = training_configuration["batch_size"]
predict_fn = model_configuration["predict_fn"]
actual_fn = model_configuration["actual_fn"]
target_features = [x["name"] for x in model_configuration["feature_config"]["target_features"]]
ignored_features = model_configuration["feature_config"]["ignored_features"]
used_targets = [x for x in target_features if x not in ignored_features]
scalers = get_scalers_for_model(model_configuration)
errors = dict()
for test_id in tqdm(test_ids):
# fetch stats for key
current_key_stats = keys_stats["by_key"][test_id]
cycle_stats = current_key_stats["cycle_stats"]
for i in range(len(cycle_stats)):
# compute cutoffs to isolate current cycle
current_cycle_start_cutoff = sum([x["cycle_length"] for x in cycle_stats[:i]])
current_cycle_end_cutoff = sum([x["cycle_length"] for x in cycle_stats[:i + 1]])
try:
batch = get_collated_batch_for_key(test_id, model_configuration,
start_cutoff=current_cycle_start_cutoff,
end_cutoff=current_cycle_end_cutoff,
lmdb_env=lmdb_env)
except ValueError:
print(f"Skipping {test_id}")
continue
if batch is None:
print(f"Empty batch, skipping {test_id}")
continue
preds = predict_fn(model, batch,
batch_size=batch_size,
device=device)
actuals = actual_fn(batch)
num_outputs = preds.shape[-1] if len(preds.shape) > 1 else 1
scaled_preds = list()
for j in range(num_outputs):
if isinstance(preds, torch.Tensor):
preds = preds.cpu().numpy()
if len(preds.shape) == 3:
output = preds[:, 0, j].squeeze()
else:
output = preds[:, j] if num_outputs > 1 else preds
if "loss_functions" in training_configuration and len(training_configuration["loss_functions"]) > j:
if isinstance(training_configuration["loss_functions"][j], nn.BCEWithLogitsLoss):
output = torch.sigmoid(torch.tensor(output)).numpy()
scaled_output = inverse_scale_feature(output,
used_targets[j],
scalers)
scaled_preds.append(scaled_output)
scaled_actuals = list()
for j in range(num_outputs):
if len(actuals.shape) == 3:
output = actuals[:, 0, j].squeeze()
else:
output = actuals[:, j] if num_outputs > 1 else actuals
if isinstance(output, torch.Tensor):
output = output.cpu().numpy()
scaled_output = inverse_scale_feature(output,
used_targets[j],
scalers).ravel()
scaled_actuals.append(scaled_output)
for eval_fn in evaluation_functions:
if eval_fn is not None:
eval_fn_name = eval_fn["name"]
eval_function = eval_fn["eval_fn"]
eval_fn_index = eval_fn["input_index"]
# skip error fn if actuals are nan, since they are ignored
if any(np.isnan(scaled_actuals[eval_fn_index])):
continue
error = eval_function(scaled_preds[eval_fn_index], scaled_actuals[eval_fn_index])
if np.isnan(error):
# skip if error is nan
continue
if eval_fn_name not in errors:
errors[eval_fn_name] = dict()
if f"after_{i}" not in errors[eval_fn_name]:
errors[eval_fn_name][f"after_{i}"] = list()
errors[eval_fn_name][f"after_{i}"].append(error)
for eval_fn in evaluation_functions:
if eval_fn is not None:
eval_fn_name = eval_fn["name"]
accumulation_fn = eval_fn["accumulation_fn"]
for key in errors[eval_fn_name]:
if len(errors[eval_fn_name][key]) == 0:
errors[eval_fn_name][key] = np.nan
else:
errors[eval_fn_name][key] = accumulation_fn(errors[eval_fn_name][key])
return errors
def pre_ov_error(preds, actuals, *args, **kwargs):
if any(np.isnan(actuals)):
return np.nan
# get ov day index
try:
ov_day_index = np.where(actuals == 0)[0][0]
except IndexError:
# no ov day in actuals
return np.nan
# get pre ov predictions
pre_ov_preds = preds[:ov_day_index]
pre_ov_actuals = actuals[:ov_day_index]
if len(pre_ov_preds) == 0 or len(pre_ov_actuals) == 0:
return np.nan
# calculate error
error = sklearn.metrics.mean_absolute_error(pre_ov_preds, pre_ov_actuals)
return error
def after_ov_error(preds, actuals, *args, **kwargs):
if any(np.isnan(actuals)):
return np.nan
# get ov day index
try:
ov_day_index = np.where(actuals == 0)[0][0]
except IndexError:
# no ov day in actuals
return np.nan
# get pre ov predictions
after_ov_preds = preds[ov_day_index:]
after_ov_actuals = actuals[ov_day_index:]
if len(after_ov_preds) == 0 or len(after_ov_actuals) == 0:
return np.nan
# calculate error
error = sklearn.metrics.mean_absolute_error(after_ov_preds, after_ov_actuals)
return error
def ov_error(preds, actuals, model_configuration, *args, **kwargs):
if any(np.isnan(actuals)):
return np.nan
# get ov day index
try:
ov_day_index = np.where(actuals == 0)[0][0]
except IndexError:
# no ov day in actuals
return np.nan
# get predicted ov index
try:
pred_ov_index = np.where(preds >= 0)[0][0]
except IndexError:
# no ov day in actuals
return np.nan
# calculate error
error = abs(pred_ov_index - ov_day_index)
# scale error to account for step size
step_size = model_configuration["preprocessing"]["window_shift"]
measurements_per_day = constants.MEASUREMENTS_PER_DAY
downsampling_factor = model_configuration["preprocessing"]["take_every_nth"]
shift_hour_factor = 24 // (measurements_per_day // downsampling_factor) * step_size
error_in_days = error * shift_hour_factor // 24
return error_in_days
def day_relative_to_ov_error(preds: np.ndarray | torch.Tensor,
actual: np.ndarray | torch.Tensor,
day_relative_to_ov: int,
model_configuration: dict) -> float:
"""
Calculate the error of the model predictions relative to the ov day
Args:
preds: predictions
actual: actual values
day_relative_to_ov: day relative to ov day
model_configuration: model configuration
Returns:
error: error of the model predictions relative to the ov day
"""
if isinstance(preds, torch.Tensor):
preds = preds.cpu().numpy()
if isinstance(actual, torch.Tensor):
actual = actual.cpu().numpy()
if any(np.isnan(actual)):
return np.nan
# get ov day index
try:
ov_day_index = np.where(actual == 0)[0][0]
except IndexError:
# no ov day in actuals
return np.nan
# get index offset factor -> how much time between each step
step_size = model_configuration["preprocessing"]["window_shift"]
measurements_per_day = constants.MEASUREMENTS_PER_DAY
downsampling_factor = model_configuration["preprocessing"]["take_every_nth"]
shift_hour_factor = 24 // (measurements_per_day // downsampling_factor) * step_size
index_offset = int(day_relative_to_ov * (shift_hour_factor // 24))
if ov_day_index + index_offset >= preds.shape[0]:
relative_day_pred = preds[-1] if len(preds.shape) > 1 else preds[-1]
elif ov_day_index + index_offset < 0:
relative_day_pred = preds[0][0] if len(preds.shape) > 1 else preds[0]
else:
relative_day_pred = preds[ov_day_index + index_offset][0] if len(preds.shape) > 1 else \
preds[ov_day_index + index_offset][0]
relative_day_actual = day_relative_to_ov
# calculate error
error = np.abs(relative_day_pred - relative_day_actual)
return error
@@ -0,0 +1,372 @@
from datetime import timedelta
from typing import Callable
import numpy as np
from vsm_datascience_common import constants
from vsm_datascience_common.cycle_database_connection.db_utils import get_cycles_collection
from vsm_datascience_common.cycles.sequences import get_timestamps, get_values
from utils.smoothing import get_curve_composition
def get_day_of_week_encoded(cycle: dict, shift: int = 0) -> dict:
timestamps = get_timestamps(cycle)
weekdays = np.array([x.weekday() for x in timestamps])
sine_encoded = np.sin(weekdays * (2 * np.pi / 7))
cosine_encoded = np.cos(weekdays * (2 * np.pi / 7))
return {
"sine": sine_encoded[shift if shift > 0 else 0:shift if shift < 0 else None],
"cosine": cosine_encoded[shift if shift > 0 else 0:shift if shift < 0 else None]
}
def get_hour_of_day_encoded(cycle: dict, shift: int = 0) -> dict:
timestamps = get_timestamps(cycle)
hours = np.array([x.hour for x in timestamps])
sine_encoded = np.sin(hours * (2 * np.pi / 24))
cosine_encoded = np.cos(hours * (2 * np.pi / 24))
return {
"sine": sine_encoded[shift if shift > 0 else 0:shift if shift < 0 else None],
"cosine": cosine_encoded[shift if shift > 0 else 0:shift if shift < 0 else None]
}
def get_month_of_year_encoded(cycle: dict, shift: int = 0) -> dict:
timestamps = get_timestamps(cycle)
months = np.array([x.month for x in timestamps])
sine_encoded = np.sin(months * (2 * np.pi / 12))
cosine_encoded = np.cos(months * (2 * np.pi / 12))
return {
"sine": sine_encoded[shift if shift > 0 else 0:shift if shift < 0 else None],
"cosine": cosine_encoded[shift if shift > 0 else 0:shift if shift < 0 else None]
}
def get_hours_from_start(cycle: dict, shift: int = 0) -> np.ndarray:
timestamps = get_timestamps(cycle)
return np.arange(len(timestamps))[shift if shift > 0 else 0:shift if shift < 0 else None]
def get_temperature(cycle: dict, shift: int = 0) -> np.ndarray:
return get_values(cycle)[shift if shift > 0 else 0:shift if shift < 0 else None]
def get_fertility_curve(cycle_length: int,
ov_index: int,
fertility_base_curve: np.ndarray | list,
base_curve_offset: int) -> np.ndarray:
fert_prob = np.zeros((cycle_length,))
if ov_index + base_curve_offset < 0:
length_in_cycle = len(fertility_base_curve) + ov_index + base_curve_offset
fert_prob[:length_in_cycle] = fertility_base_curve[-length_in_cycle:]
elif ov_index + base_curve_offset + len(fertility_base_curve) > cycle_length:
length_in_cycle = cycle_length - ov_index - base_curve_offset
fert_prob[ov_index + base_curve_offset:] = fertility_base_curve[:length_in_cycle]
else:
fert_prob[ov_index + base_curve_offset:
ov_index + base_curve_offset + len(fertility_base_curve)] = fertility_base_curve
return fert_prob
def get_fertility_probability_base_curve() -> (np.ndarray, int):
"""
This function returns the base curve for the fertility probability as well as the offset to the ovulation day in measurements
:return: numpy array with the base curve resampled to the number of measurements per day
"""
fertilization_chance_curve = [0, 0.07, 0.12, 0.25, 0.3, 0.18, 0]
offset_to_ov = -6
new_indices = np.arange(len(fertilization_chance_curve) * constants.MEASUREMENTS_PER_DAY)
fertility_chance_curve_resampled = np.interp(new_indices,
np.linspace(0, len(new_indices), num=len(fertilization_chance_curve)),
fertilization_chance_curve)
ov_offset_resampled = offset_to_ov * constants.MEASUREMENTS_PER_DAY
return fertility_chance_curve_resampled, ov_offset_resampled
def get_fertility_probability(cycle: dict, shift: int = 0) -> np.ndarray:
# check, if biphasic
if "classification_results" in cycle and "results" in cycle["classification_results"][0]:
if cycle["classification_results"][0]["results"]["predicted_class"] != "biphasic":
return np.zeros((len(get_values(cycle)) - abs(shift, )))
else:
return np.zeros((len(get_values(cycle)) - abs(shift, )))
if "ov_detection_results" in cycle and "results" in cycle["ov_detection_results"][0]:
try:
ov_timestamp = cycle["ov_detection_results"][0]["results"]["ovulation_timestamp"]
timestamps = get_timestamps(cycle)
ov_index = np.where(timestamps >= ov_timestamp)[0][0]
fertility_chance_curve_resampled, ov_offset_resampled = get_fertility_probability_base_curve()
return get_fertility_curve(len(get_values(cycle)), ov_index, fertility_chance_curve_resampled,
ov_offset_resampled)[shift if shift > 0 else 0:shift if shift < 0 else None]
except:
return np.zeros((len(get_values(cycle)) - abs(shift, )))
else:
return np.zeros((len(get_values(cycle)) - abs(shift, )))
def get_ov_over_probability(cycle: dict, shift: int = 0) -> np.ndarray:
"""
Get the ovulation over probability for a cycle
:param cycle: cycle data
:param shift: shift to apply
:return: ovulation over probability
"""
if "ov_detection_results" in cycle and "results" in cycle["ov_detection_results"][0]:
try:
ov_timestamp = cycle["ov_detection_results"][0]["results"]["ovulation_timestamp"]
timestamps = get_timestamps(cycle)
ov_index = np.where(timestamps > ov_timestamp)[0][0]
ov_over_probability = np.zeros(len(get_values(cycle)))
ov_over_probability[ov_index:] = 1
return ov_over_probability[shift if shift > 0 else 0:shift if shift < 0 else None]
except:
return np.zeros(len(get_values(cycle)))[shift if shift > 0 else 0:shift if shift < 0 else None]
else:
return np.zeros(len(get_values(cycle)))[shift if shift > 0 else 0:shift if shift < 0 else None]
def get_days_relative_to_ov(cycle: dict) -> np.ndarray:
"""
Get the time in days until the next OV event.
"""
timestamps = get_timestamps(cycle)
if ("ov_detection_results" in cycle and "results" in cycle["ov_detection_results"][0]) and (
"classification_results" in cycle and "results" in cycle["classification_results"][0] and
cycle["classification_results"][0]["results"]["predicted_class"] == "biphasic"):
try:
ov_timestamp = cycle["ov_detection_results"][0]["results"]["ovulation_timestamp"]
ov_index = np.where(timestamps > ov_timestamp)[0][0]
ov_timestamp = timestamps[ov_index]
days_until_ov = np.empty(len(timestamps))
for i in range(len(timestamps)):
current_day = timestamps[i]
day_diff = ov_timestamp - current_day
if day_diff.days < -1:
pass
# days_until_ov[i] = max(day_diff.days -1)
# use - days, as days relative to event
days_until_ov[i] = - day_diff.days
return np.array(days_until_ov)
except:
pass
return np.full((len(timestamps),), np.nan)
def get_ov_day(cycle: dict) -> np.ndarray:
"""
Get the ovulation day for a cycle
:param cycle: cycle data
:return: ovulation day
"""
values = get_values(cycle)
seq_len = len(values)
is_biphasic = "classification_results" in cycle and "results" in cycle["classification_results"][0] and \
cycle["classification_results"][0]["results"]["predicted_class"] == "biphasic"
has_ov_results = "ov_detection_results" in cycle and "results" in cycle["ov_detection_results"][0]
if is_biphasic and has_ov_results:
try:
ov_day = cycle["ov_detection_results"][0]["results"]["ovulation_day"]
return np.full((seq_len,), ov_day)
except:
pass
return np.full((seq_len,), np.nan)
def get_is_biphasic(cycle: dict) -> np.ndarray:
"""
Get the is_biphasic flag for a cycle
:param cycle: cycle data
:return: is_biphasic flag
"""
values = get_values(cycle)
seq_len = len(values)
is_biphasic = "classification_results" in cycle and "results" in cycle["classification_results"][0] and \
cycle["classification_results"][0]["results"]["predicted_class"] == "biphasic"
if is_biphasic:
return np.full((seq_len,), 1)
return np.full((seq_len,), 0)
def get_curve_composition_as_features(cycle: dict, shift: int = 0) -> dict:
composition = get_curve_composition(get_values(cycle))
return {
"trend": composition[0][shift if shift > 0 else 0:shift if shift < 0 else None],
"seasonal": composition[1][shift if shift > 0 else 0:shift if shift < 0 else None],
"residual": composition[2][shift if shift > 0 else 0:shift if shift < 0 else None],
"smoothed": composition[3][shift if shift > 0 else 0:shift if shift < 0 else None]
}
def get_rolling_average_with_padding(cycle: dict,
shift: int = 0,
rolling_average_window_length: int = constants.MEASUREMENTS_PER_DAY) -> np.ndarray:
"""
Get the rolling average of the temperature values with padding, so that the rolling average has the same length as the
original temperature values
Args:
cycle (dict): cycle data
shift (int): shift to apply
rolling_average_window_length (int): window length for the rolling average, default is one day (288 measurements)
Returns:
np.ndarray: rolling average of the temperature values with padding
"""
values = get_values(cycle)
values_padded = np.concatenate(
[np.full((constants.MEASUREMENTS_PER_DAY,), np.mean(values[:constants.MEASUREMENTS_PER_DAY])), values])
rolling_average = np.convolve(values_padded, np.ones(rolling_average_window_length) / rolling_average_window_length,
mode="valid")[-len(values):]
return rolling_average[shift if shift > 0 else 0:shift if shift < 0 else None]
def get_window_fn(cycle: dict,
window_size: int,
fn: Callable) -> np.ndarray:
"""
Apply a window function to a time series.
:param cycle: cycle data
:param window_size: window size
:return: array with minimum value in window for each value in input array
"""
values = get_values(cycle)
values_padded = np.concatenate([np.full(window_size - 1, values[0]), values])
windows = np.lib.stride_tricks.sliding_window_view(values_padded, window_shape=window_size)
return fn(windows)
def get_cycle_length_stats(cycle: dict) -> dict:
user_id = cycle["user_id"]
cycle_length = len(get_values(cycle))
cycles_dates = list(get_cycles_collection().find({
"user_id": user_id, "ends_at": {"$exists": True},
"starts_at": {"$lt": cycle["starts_at"]},
},
{"starts_at": 1, "ends_at": 1}))
if len(cycles_dates) == 0:
# use the average cycle length as fallback
average_cycle_length = 37.13
cycle_length_std = 12.42
else:
cycle_lengths = [x["ends_at"] - x["starts_at"] for x in cycles_dates]
average_cycle_length = np.mean(cycle_lengths).total_seconds() / (60 * 60 * 24)
cycle_length_std = np.std([x.total_seconds() for x in cycle_lengths]) / (60 * 60 * 24)
return {
"average_cycle_length": np.full((cycle_length,), average_cycle_length),
"cycle_length_std": np.full((cycle_length,), cycle_length_std),
}
def get_average_ovulation_day(cycle: dict) -> float:
user_id = cycle["user_id"]
cycle_length = len(get_values(cycle))
cycles_dates = list(
get_cycles_collection().find({
"user_id": user_id,
"ov_detection_results.0.results": {"$exists": True},
"starts_at": {"$lt": cycle["starts_at"]},
},
{"ov_detection_results": 1}))
if len(cycles_dates) == 0:
# use the average ovulation day as fallback
average_ovulation_day = 18.9
else:
ovulation_days = [x["ov_detection_results"][0]["results"]["ovulation_day"] for x in cycles_dates]
average_ovulation_day = np.mean(ovulation_days)
return np.full((cycle_length,), average_ovulation_day)
def get_ovulation_std(cycle: dict) -> float:
user_id = cycle["user_id"]
cycle_length = len(get_values(cycle))
cycles_dates = list(
get_cycles_collection().find({
"user_id": user_id,
"ov_detection_results.0.results": {"$exists": True},
"starts_at": {"$lt": cycle["starts_at"]},
},
{"ov_detection_results": 1}))
if len(cycles_dates) == 0:
# use the average ovulation std as fallback
ovulation_std = 4.07
else:
ovulation_days = [x["ov_detection_results"][0]["results"]["ovulation_day"] for x in cycles_dates]
ovulation_std = np.std(ovulation_days)
return np.full((cycle_length,), ovulation_std)
def get_biphasic_fraction(cycle: dict) -> float:
user_id = cycle["user_id"]
cycle_length = len(get_values(cycle))
cycle_dates = list(
get_cycles_collection().find({
"user_id": user_id,
"classification_results.0.results": {"$exists": True},
"starts_at": {"$lt": cycle["starts_at"]},
},
{"classification_results": 1}))
if len(cycle_dates) == 0:
# use the average cycle length as fallback
biphasic_fraction = 0.9449
else:
biphasic = [x for x in cycle_dates if
x["classification_results"][0]["results"]["predicted_class"] == "biphasic"]
biphasic_fraction = len(biphasic) / len(cycle_dates)
return np.full((cycle_length,), biphasic_fraction)
def get_num_cycles(cycle: dict) -> int:
user_id = cycle["user_id"]
cycle_length = len(get_values(cycle))
cycles_dates = list(get_cycles_collection().find({"user_id": user_id,
"ends_at": {"$exists": True},
"starts_at": {"$lt": cycle["starts_at"]}
},
{"starts_at": 1, "ends_at": 1}))
num_cycles = len(cycles_dates)
return np.full((cycle_length,), num_cycles)
def get_average_temperatures(cycle: dict) -> dict:
user_id = cycle["user_id"]
cycle_length = len(get_values(cycle))
cycles_dates = list(
get_cycles_collection().find({"user_id": user_id, "ov_detection_results.0.results": {"$exists": True}},
{"starts_at": 1, "ov_detection_results": 1, "measurements": 1}))
if len(cycles_dates) == 0:
return {
"pre_ov_temperatures": np.full((cycle_length,), 37.07),
"post_ov_temperatures": np.full((cycle_length,), 37.37),
}
pre_ov_temperatures = []
post_ov_temperatures = []
for x in cycles_dates:
ov_detection = x["ov_detection_results"][0]["results"]
values = get_values(x)
timestamps = get_timestamps(x)
cutoff_day = x["starts_at"] + timedelta(days=ov_detection["ovulation_day"])
cutoff_index = np.where(np.array(timestamps) >= cutoff_day)[0][0]
pre_ov_temperatures.append(values[:cutoff_index])
post_ov_temperatures.append(values[cutoff_index:])
pre_ov_temperatures = np.concatenate(pre_ov_temperatures)
post_ov_temperatures = np.concatenate(post_ov_temperatures)
pre_ov_temperatures = np.mean(pre_ov_temperatures)
post_ov_temperatures = np.mean(post_ov_temperatures)
return {
"pre_ov_temperatures": np.full((cycle_length,), pre_ov_temperatures),
"post_ov_temperatures": np.full((cycle_length,), post_ov_temperatures),
}
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import pickle
import pandas as pd
def save_to_lmdb(env, key, dataset):
"""
Saves the given dataset to an LMDB environment with the given key.
:param env: LMDB environment
:param key: key to save the dataset to
:param dataset: tuple of pandas dataframes
"""
with env.begin(write=True) as txn:
txn.put(key.encode('ascii'), pickle.dumps(dataset))
def load_from_lmdb(env, key):
"""
Loads a dataset from an LMDB environment with the given key.
:param env: LMDB environment
:param key: key of the dataset to load
:return: key and tuple of pandas dataframes (input, context, output)
"""
with env.begin(write=False) as txn:
try:
data = pickle.loads(txn.get(key.encode('ascii')))
return data
except TypeError:
raise KeyError(key)
def delete_from_lmdb(env, key):
"""
Deletes a dataset from an LMDB environment with the given key.
:param env: LMDB environment
:param key: key of the dataset to delete
"""
with env.begin(write=True) as txn:
txn.delete(key.encode('ascii'))
def clear_lmdb(env):
"""
Clears all datasets from an LMDB environment.
:param env: LMDB environment
"""
with env.begin(write=True) as txn:
cursor = txn.cursor()
for key, value in cursor:
txn.delete(key)
def lmdb_dataset_generator(env):
"""
Generator function to yield datasets from an LMDB environment.
:param env: LMDB environment
:return: generator
"""
with env.begin(write=False) as txn:
cursor = txn.cursor()
for key, value in cursor:
data = pickle.loads(value)
yield data
def lmdb_contains(env, substring) -> bool:
"""
Checks if the given substring is contained in any of the keys of the LMDB environment.
:param env: LMDB environment
:param substring: substring to search for
:return: boolean
"""
with env.begin(write=False) as txn:
cursor = txn.cursor()
for key, value in cursor:
if substring in key.decode('ascii'):
return True
return False
def lmdb_substring_key_search(env, substring):
"""
Searches for keys in the LMDB environment that contain the given substring.
:param env: LMDB environment
:param substring: substring to search for
:return: list of keys
"""
keys = []
with env.begin(write=False) as txn:
cursor = txn.cursor()
for key, value in cursor:
if substring in key.decode('ascii'):
keys.append(key)
return keys
def get_lmdb_keys(env, limit: int = None):
"""
Get all keys in the LMDB environment.
:param env: LMDB environment
:param limit: maximum number of keys to return
:return: list of keys
"""
with env.begin(write=False) as txn:
with txn.cursor() as cursor:
keys = [key.decode("ascii") for key in cursor.iternext(keys=True, values=False)]
return keys
def get_lmdb_keyspace_size(env):
"""
Get the number of keys in the LMDB environment.
:param env: LMDB environment
:return: number of keys
"""
with env.begin(write=False) as txn:
return txn.stat()['entries']
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import torch
from torch import nn
import torch.nn.functional as F
import numpy as np
class QuantileLoss(nn.Module):
def __init__(self, config):
super().__init__()
self.register_buffer('q', torch.tensor(config.quantiles))
def forward(self, predictions, targets):
diff = predictions - targets.unsqueeze(-1).expand(-1, -1, -1, predictions.shape[-1])
ql = (1 - self.q) * F.relu(diff) + self.q * F.relu(-diff)
losses = ql.view(-1, ql.shape[-1]).mean(0)
return losses
def qrisk(pred, tgt, quantiles):
diff = pred - tgt
ql = (1 - quantiles) * np.clip(diff, 0, float('inf')) + quantiles * np.clip(-diff, 0, float('inf'))
losses = ql.reshape(-1, ql.shape[-1])
normalizer = np.abs(tgt).mean()
risk = 2 * losses / normalizer
return risk.mean(0)
def weighted_bce_loss_fn():
bce = nn.BCEWithLogitsLoss(reduction="none") # Use reduction="none" to get per-element loss
use_class_weights = False
time_weight_factor = 1
def _loss_fn(y_pred, y_true):
loss_list = [] # To accumulate per-sample loss values
for i in range(len(y_pred)):
current_pred = y_pred[i]
current_true = y_true[i]
loss_raw = bce(current_pred, current_true)
if use_class_weights:
# Calculate class weights using torch operations
try:
factor = torch.max(current_true) / torch.mean(current_true) / 2
non_zero_indices = current_true != 0
class_weights = torch.ones_like(current_pred)
class_weights[non_zero_indices] = factor
except Exception:
class_weights = torch.ones_like(current_pred)
else:
class_weights = torch.ones_like(current_pred)
# Calculate time weights using torch operations
try:
# Find indices where the event occurs
event_indices = torch.where(current_true == 1)[0]
if len(event_indices) > 0:
first_event_index = event_indices[0].item()
time_weights = torch.ones_like(current_pred)
# Weight the loss before the first event higher if needed
time_weights[:first_event_index] = time_weight_factor
else:
time_weights = torch.ones_like(current_pred)
except Exception:
time_weights = torch.ones_like(current_pred)
# Apply the weights to the raw loss
loss = loss_raw * class_weights * time_weights
# Optionally, take the mean over the time dimension
loss_list.append(loss.mean())
# Aggregate the loss for the entire batch
return torch.stack(loss_list).mean()
return _loss_fn
def weighted_mse_prob_loss_fn():
mse = nn.MSELoss(reduce=False)
after_event_factor = 1
use_weighted = False
def _loss_fn(y_pred, y_true):
nonlocal mse, after_event_factor
loss_list = list()
for i in range(len(y_pred)):
current_pred = y_pred[i]
current_true = y_true[i]
loss_raw = mse(current_pred, current_true)
# calculate factor to use for weighting, only works with probability values
if use_weighted:
try:
factor = torch.max(current_true) / torch.mean(current_true) / 2
non_zero_indices = current_true != 0
class_weights = np.ones(len(current_true))
class_weights[non_zero_indices] = factor
except:
# if there are no non-zero indices, set all weights to 1
class_weights = np.ones(len(current_true))
else:
# if we don't want to weight the loss, set all weights to 1
class_weights = np.ones(len(current_true))
# calculate time weight, here, after the event, the loss should be higher
try:
last_event_index = np.where(current_true != 0)[-1]
time_weights = np.zeros(len(current_true))
# here, we want to weight the loss after the 'fertility curve' higher, so that we don't get the signal too late
time_weights[last_event_index:] = after_event_factor
except:
# if there are no non-zero indices, set all weights to 1
time_weights = np.ones(len(current_true))
loss = loss_raw * torch.tensor(class_weights) * torch.tensor(time_weights)
loss_list.append(loss.mean())
return torch.stack(loss_list).mean()
return _loss_fn
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import os
import pickle
from datetime import datetime
from utils.utils import get_config_id
def get_model_config(base_config: dict,
base_result_dir: str,
dataset_base_dir: str):
# get config identifier
# name_for_current_config = base_config["model_name"] + "_" + get_config_id(base_config)
date_part = datetime.now().strftime("%Y_%m_%d_%H_%M")
name_for_current_config = base_config["model_name"] + "_" + date_part
model_dir = os.path.abspath(f"{base_result_dir}/{name_for_current_config}")
if not os.path.exists(model_dir):
# create config
os.makedirs(model_dir)
# append identifier to config
config = base_config.copy()
config["id"] = name_for_current_config
# append paths
config["model_dir"] = model_dir
config["dataset_dir"] = os.path.join(dataset_base_dir, config["feature_config"]["feature_set_name"])
config["feature_config"]["dataset_dir"] = config["dataset_dir"]
# save model configuration
with open(f"{model_dir}/model_configuration.pickle", "wb") as f:
pickle.dump(config, f)
else:
# fetch config
with open(f"{model_dir}/model_configuration.pickle", "rb") as f:
config = pickle.load(f)
# append paths
config["model_dir"] = model_dir
config["dataset_dir"] = os.path.join(dataset_base_dir, config["feature_config"]["feature_set_name"])
config["feature_config"]["dataset_dir"] = config["dataset_dir"]
return config
def get_model_config_from_file(model_dir: str,
model_base_dir: str,
lmdb_base_dir: str):
# fetch config
with open(f"{model_dir}/model_configuration.pickle", "rb") as f:
config = pickle.load(f)
# update paths based on base directories
config["model_dir"] = os.path.abspath(f"{model_base_dir}/{config['id']}")
config["feature_config"]["dataset_dir"] = os.path.abspath(
f"{lmdb_base_dir}/{config['feature_config']['feature_set_name']}")
return config
def save_model_config(model_dir: str, model_config: dict):
# save model configuration
with open(f"{model_dir}/model_configuration.pickle", "wb") as f:
pickle.dump(model_config, f)
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import numpy as np
from scipy.signal import butter, filtfilt
from statsmodels.tsa.stl._stl import STL
def highpass_filter(data, cutoff_freq, fs=288):
nyquist = 0.5 * fs
normal_cutoff = cutoff_freq / nyquist
b, a = butter(N=3, Wn=normal_cutoff, btype="high", analog=False)
return filtfilt(b, a, data)
def mirror_extend(series, extend_len):
"""Mirrors the beginning and end of the time series to stabilize smoothing."""
# Mirror extension
start_extension = series[:extend_len][::-1] # Reverse first part
end_extension = series[-extend_len:][::-1] # Reverse last part
extended_series = np.concatenate([start_extension, series, end_extension])
return extended_series
def get_trend(input_curve: np.ndarray | list, measurements_per_day: int = 288) -> np.ndarray:
extension_len = 3
extended_input_curve = mirror_extend(input_curve, extension_len * measurements_per_day)
stl = STL(extended_input_curve, period=measurements_per_day, robust=False, trend=measurements_per_day * 14 + 1)
trend = stl.fit().trend
return trend[extension_len * measurements_per_day:-extension_len * measurements_per_day]
def get_curve_composition(input_curve: np.ndarray | list, measurements_per_day: int = 288) -> tuple:
"""
Decomposes the input curve into trend, seasonal, residual and smoothed components.
:param input_curve: raw input curve
:param measurements_per_day: seasonal period, here: measurements per day -> 288
:return: composition of curve as tuple (trend, seasonal, residual, smoothed)
"""
extension_len = 3
extended_input_curve = mirror_extend(input_curve, extension_len * measurements_per_day)
stl_results = STL(extended_input_curve, period=measurements_per_day, robust=False).fit()
long_term = (extended_input_curve - stl_results.seasonal)
wiggles = highpass_filter(long_term, 0.1)
smoothed = long_term - wiggles
return (
stl_results.trend[extension_len * measurements_per_day:-extension_len * measurements_per_day],
stl_results.seasonal[extension_len * measurements_per_day:-extension_len * measurements_per_day],
stl_results.resid[extension_len * measurements_per_day:-extension_len * measurements_per_day],
smoothed[extension_len * measurements_per_day:-extension_len * measurements_per_day],
)
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import math
import torch
from torch import nn
from torch.optim import AdamW
from torch.optim.lr_scheduler import OneCycleLR
from torch.utils.data import IterableDataset, DataLoader
from torch.utils.tensorboard import SummaryWriter
from tqdm import tqdm
from utils.data_utils import LMDBIterableDataset
from utils.utils import get_logger
def process_tft_batch(model: nn.Module,
data_iterator: IterableDataset,
loss_functions: list,
device: torch.device,
model_configuration: dict) -> torch.Tensor:
batch = next(data_iterator)
batch = {k: v.to(device) for k, v in batch.items() if v is not None}
input_window_length = model_configuration["model_parameters"]["encoder_length"]
preds = model(batch).cpu() # [B, decoder_len, Q]
target = batch["target"][:, input_window_length:, :].cpu() # match decoder segment
loss = get_x_y_loss(preds, target, loss_functions)
return loss
def get_x_y_loss(pred: torch.Tensor,
target: torch.Tensor,
loss_functions: list,
*args, **kwargs) -> torch.Tensor:
if len(loss_functions) > 1:
losses = list()
for dim in range(target.shape[-1]):
if len(pred.shape) > 2:
current_preds = pred[:, :, dim].ravel()
else:
current_preds = pred[:, dim]
if len(target.shape) > 2:
current_target = target[:, :, dim].ravel()
else:
current_target = target[:, dim].ravel()
# skip dimension, if it contains only NaN values, as loss cens
nan_indices = torch.isnan(current_target)
if torch.all(nan_indices):
continue
current_target = current_target[~nan_indices]
current_preds = current_preds[~nan_indices]
if len(current_target) == 0:
continue
loss = loss_functions[dim](current_preds, current_target)
losses.append(loss)
loss = torch.stack(losses).mean()
else:
nan_indices = torch.isnan(target)
if torch.all(nan_indices):
return torch.tensor(0.0)
current_target = target[~nan_indices]
current_preds = pred[~nan_indices]
if len(current_target) == 0:
return torch.tensor(0.0)
loss = loss_functions[0](current_preds, current_target)
return loss
def get_model_loss(model: nn.Module,
data_iterator: IterableDataset,
loss_functions: list,
device: str,
*args, **kwargs) -> torch.Tensor:
batch_x, batch_y = next(data_iterator)
batch_x = batch_x.to(device).float()
target = batch_y.to(device).float()
pred = model(batch_x)
loss = get_x_y_loss(pred, target, loss_functions)
return loss
def get_ranked_ids(all_ids, epoch, rank, world_size, base_seed=42):
"""
Get ranked ids for distributed training.
Args:
all_ids: list of all available ids
epoch: current epoch
rank: rank of the current process
world_size: number of processes
base_seed: base seed for random number generator
Returns:
list of ids for the current process
"""
g = torch.Generator()
g.manual_seed(base_seed + epoch)
permuted = torch.randperm(len(all_ids), generator=g).tolist()
return [all_ids[i] for i in permuted[rank::world_size]]
def train_model(model: nn.Module,
model_configuration: dict,
training_configuration: dict,
train_dataset: LMDBIterableDataset,
val_dataset: LMDBIterableDataset,
log_dir: str = "./logs",
logger=None) -> torch.nn.Module:
if logger is None:
logger = get_logger(__name__, f"{log_dir}/{model_configuration['id']}_{training_configuration['id']}.log")
learning_parameters = training_configuration["learning_parameters"]
num_epochs = learning_parameters["epochs"]
patience = learning_parameters["patience"]
training_id = training_configuration["id"]
# get computation rank
if torch.distributed.is_initialized():
local_rank = torch.distributed.get_rank()
torch.cuda.set_device(local_rank)
device = torch.device(f"cuda:{local_rank}")
world_size = torch.distributed.get_world_size()
else:
local_rank = 0
device = torch.device("cuda" if torch.cuda.is_available() else "cpu")
world_size = 1
logger.info(f"Rank {local_rank}: Using device: {device}, world size: {world_size}")
# get subsets for distributed training
if torch.distributed.is_initialized():
all_train_ids = train_dataset.lmdb_keys
train_subsets = [get_ranked_ids(all_train_ids, i, local_rank, world_size) for i in range(num_epochs)]
# calc total number of steps for gpu, as it is dependent on subsets
total_train_steps = sum([train_dataset.get_length_of_data_subset(subset) for subset in train_subsets])
all_val_ids = val_dataset.lmdb_keys
val_subsets = [get_ranked_ids(all_val_ids, i, local_rank, world_size) for i in range(num_epochs)]
else:
train_subsets = [train_dataset.lmdb_keys] * num_epochs
val_subsets = [val_dataset.lmdb_keys] * num_epochs
total_train_steps = len(train_dataset)
# log the number of training steps for each epoch
train_subset_lengths = {f"epoch_{i}": len(subset) for i, subset in enumerate(train_subsets)}
logger.info(f"Train_subsets: {train_subset_lengths}")
logger.info(f"Rank {local_rank}: Total training steps: {total_train_steps}")
# initialize loaders for non distributed
if not torch.distributed.is_initialized():
# set the subsets for the datasets
train_dataset.set_key_subset(train_subsets[0])
val_dataset.set_key_subset(val_subsets[0])
# create data loaders
train_dataloader = DataLoader(
train_dataset,
batch_size=None,
num_workers=4,
)
val_dataloader = DataLoader(
val_dataset,
batch_size=None,
num_workers=4,
)
logger.info(f"Rank {local_rank}: Training {training_id} with {num_epochs} epochs")
logger.info(f"Rank {local_rank}: Training on {torch.cuda.device_count()} GPUs")
logger.info(
f"Rank {local_rank}: Current device: {torch.cuda.get_device_name(local_rank)} on local rank {local_rank}")
model.to(device)
# load training state from training configuration, if available
optimizer = AdamW(model.parameters(), lr=learning_parameters["learning_rate"])
scheduler = OneCycleLR(optimizer,
max_lr=learning_parameters["learning_rate"],
# make sure to use length of full dataset here
total_steps=total_train_steps)
current_epoch = 1
loss_functions = training_configuration["loss_functions"]
# loss_fn = nn.MSELoss()
writer = SummaryWriter(log_dir=f'{log_dir}/{model_configuration["id"]}_{training_id}', )
best_val_loss = math.inf
epochs_no_improve = 0
log_every_n_steps = max(len(train_dataset) // 500, 1)
batch_loss_fn = model_configuration["batch_loss_fn"]
for epoch in range(current_epoch, num_epochs + 1):
logger.info(f"Rank {local_rank}: Epoch {epoch}/{num_epochs}")
model.train()
total_train_loss = 0
# on distributed training, reshuffle the data
if torch.distributed.is_initialized():
# update the datasets with the new ids
train_dataset.set_key_subset(train_subsets[epoch - 1])
val_dataset.set_key_subset(val_subsets[epoch - 1])
# recreate data loaders
train_dataloader = DataLoader(
train_dataset,
batch_size=None,
num_workers=4,
)
val_dataloader = DataLoader(
val_dataset,
batch_size=None,
num_workers=4,
)
iterator = iter(train_dataloader)
for step in tqdm(range(len(train_dataloader)), total=len(train_dataloader)):
loss = batch_loss_fn(model,
iterator,
loss_functions,
device,
model_configuration)
optimizer.zero_grad()
loss.backward()
optimizer.step()
scheduler.step()
total_train_loss += loss.item()
if local_rank == 0:
if step % log_every_n_steps == 0:
writer.add_scalar("Loss/Train_Step", loss.item(),
((epoch - 1) * len(train_dataloader) + step) * training_configuration[
"batch_size"])
writer.add_scalar("LR", scheduler.get_last_lr()[0],
((epoch - 1) * len(train_dataloader) + step) * training_configuration[
"batch_size"])
writer.flush()
avg_train_loss = total_train_loss / len(train_dataloader)
logger.info(f"Rank {local_rank}: Epoch {epoch}/{num_epochs} done. Train loss: {avg_train_loss:.4f}")
# Validation
model.eval()
total_val_loss = 0
logger.info(f"Rank {local_rank}: Validation")
with torch.no_grad():
val_iter = iter(val_dataloader)
for step in tqdm(range(len(val_dataloader))):
loss = batch_loss_fn(model,
val_iter,
loss_functions,
device,
model_configuration)
total_val_loss += loss.item()
if len(val_dataloader) == 0:
logger.info(f"Rank {local_rank}: Validation set is empty, using 0 as validation loss.")
avg_val_loss = None
else:
avg_val_loss = total_val_loss / len(val_dataloader)
# publish validation loss and wait for other gpus
if torch.distributed.is_initialized():
if avg_val_loss is not None:
avg_val_loss_global = torch.tensor(avg_val_loss, device=device, dtype=torch.float32)
torch.distributed.all_reduce(avg_val_loss_global)
avg_val_loss_global /= torch.distributed.get_world_size()
avg_train_loss_global = torch.tensor(avg_train_loss).to(device)
torch.distributed.all_reduce(avg_train_loss_global)
avg_train_loss_global /= torch.distributed.get_world_size()
else:
avg_val_loss_global = torch.tensor(avg_val_loss)
avg_train_loss_global = torch.tensor(avg_train_loss)
# only rank 0 checks for early stopping
if local_rank == 0:
logger.info(f"Rank {local_rank}: Epoch {epoch}/{num_epochs} done. Val loss: {avg_val_loss:.4f}")
writer.add_scalar("Loss/Train_Epoch", avg_train_loss_global, epoch)
writer.add_scalar("Loss/Val_Epoch", avg_val_loss_global, epoch)
writer.flush()
# Early stopping
should_stop = False
if avg_val_loss_global < best_val_loss:
logger.info(
f"Rank {local_rank}: Validation loss improved from {best_val_loss:.4f} to {avg_val_loss_global:.4f}.")
best_val_loss = avg_val_loss_global
epochs_no_improve = 0
# torch.save(model.state_dict(), os.path.join(model_configuration["id"], "model.pt"))
save_fn = model_configuration["model_save_fn"]
save_fn(model, training_configuration)
else:
epochs_no_improve += 1
logger.info(
f"Rank {local_rank}: No improvement in validation loss, no-improve count: {epochs_no_improve}")
if epochs_no_improve >= patience:
logger.info("Early stopping triggered.")
# broadcast stop signal to all gpus
should_stop = True
else:
should_stop = None
if torch.distributed.is_initialized():
if local_rank == 0:
should_stop_tensor = torch.tensor([int(should_stop)], device=device)
else:
should_stop_tensor = torch.zeros(1, dtype=torch.uint8, device=device) # safe default
torch.distributed.broadcast(should_stop_tensor, src=0)
should_stop = bool(should_stop_tensor.item())
if should_stop:
logger.info(f"Rank {local_rank}: Stopping training.")
break
# ensure sync between epochs
if torch.distributed.is_initialized():
torch.distributed.barrier()
# clean up
del loss
del train_dataloader
del val_dataloader
del model
del optimizer
del scheduler
# free up memory
torch.cuda.synchronize()
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import os
import pickle
import random
from datetime import datetime
import numpy as np
import torch
from torch import nn
from torch.nn import init
from sklearn.model_selection import train_test_split
import lmdb
from bson import ObjectId
from tqdm import tqdm
from utils.lmdb_utils import get_lmdb_keys
from utils.utils import get_config_id
from utils.data_utils import produce_window_batches
from vsm_datascience_common.cycle_database_connection.db_utils import get_cycles_collection
def get_training_config(base_config: dict, model_config: dict):
try:
if base_config["model_class"] != model_config["model_class"]:
raise Exception("Model type differ in model config and training config")
except KeyError:
raise Exception("Model class missing in training or model config")
# training_config_id = get_config_id(base_config)
# hash = training_config_id[-5:]
timestamp = datetime.now().strftime("%Y%m%d-%H%M")
training_config_id = f"{timestamp}"
training_dir = os.path.abspath(f"{model_config['model_dir']}/trainings/{training_config_id}")
# append identifier to config
training_config = base_config.copy()
training_config["id"] = training_config_id
training_config["training_dir"] = training_dir
if not os.path.isdir(training_dir):
os.makedirs(training_dir)
# save training configuration
with open(f"{training_dir}/training_configuration.pickle", "wb") as f:
pickle.dump(training_config, f)
else:
# fetch config
with open(f"{training_dir}/training_configuration.pickle", "rb") as f:
training_config = pickle.load(f)
return training_config
def get_training_config_from_file(training_dir: str,
base_model_dir: str,
model_configuration: dict) -> dict:
# fetch config
with open(f"{training_dir}/training_configuration.pickle", "rb") as f:
training_config = pickle.load(f)
# update paths based on base directories
training_config["training_dir"] = os.path.join(os.path.abspath(base_model_dir),
model_configuration["id"],
"trainings",
training_config["id"])
return training_config
def weight_init(m):
"""
Usage:
model = Model()
model.apply(weight_init)
"""
if isinstance(m, nn.Conv1d):
init.normal_(m.weight.data)
if m.bias is not None:
init.normal_(m.bias.data)
elif isinstance(m, nn.Conv2d):
init.xavier_normal_(m.weight.data)
if m.bias is not None:
init.normal_(m.bias.data)
elif isinstance(m, nn.Conv3d):
init.xavier_normal_(m.weight.data)
if m.bias is not None:
init.normal_(m.bias.data)
elif isinstance(m, nn.ConvTranspose1d):
init.normal_(m.weight.data)
if m.bias is not None:
init.normal_(m.bias.data)
elif isinstance(m, nn.ConvTranspose2d):
init.xavier_normal_(m.weight.data)
if m.bias is not None:
init.normal_(m.bias.data)
elif isinstance(m, nn.ConvTranspose3d):
init.xavier_normal_(m.weight.data)
if m.bias is not None:
init.normal_(m.bias.data)
elif isinstance(m, nn.BatchNorm1d):
init.normal_(m.weight.data, mean=1, std=0.02)
init.constant_(m.bias.data, 0)
elif isinstance(m, nn.BatchNorm2d):
init.normal_(m.weight.data, mean=1, std=0.02)
init.constant_(m.bias.data, 0)
elif isinstance(m, nn.BatchNorm3d):
init.normal_(m.weight.data, mean=1, std=0.02)
init.constant_(m.bias.data, 0)
elif isinstance(m, nn.Linear):
init.xavier_normal_(m.weight.data)
if m.bias is not None:
init.normal_(m.bias.data)
elif isinstance(m, nn.LSTM):
for param in m.parameters():
if len(param.shape) >= 2:
init.orthogonal_(param.data)
else:
init.normal_(param.data)
elif isinstance(m, nn.LSTMCell):
for param in m.parameters():
if len(param.shape) >= 2:
init.orthogonal_(param.data)
else:
init.normal_(param.data)
elif isinstance(m, nn.GRU):
for param in m.parameters():
if len(param.shape) >= 2:
init.orthogonal_(param.data)
else:
init.normal_(param.data)
for names in m._all_weights:
for name in filter(lambda n: "bias" in n, names):
bias = getattr(m, name)
n = bias.size(0)
bias.data[:n // 3].fill_(-1.)
elif isinstance(m, nn.GRUCell):
for param in m.parameters():
if len(param.shape) >= 2:
init.orthogonal_(param.data)
else:
init.normal_(param.data)
def collate(batch_items: list) -> dict:
batch = dict()
for key in batch_items[0].keys():
if key in ["combination_id", "time_index"]:
continue
else:
if batch_items[0][key] is None:
batch[key] = None
else:
batch[key] = np.stack([item[key] for item in batch_items])
for key in batch.keys():
if batch[key] is not None:
batch[key] = torch.tensor(batch[key], dtype=torch.float32)
return batch
def get_splits_by_user(input_keys: list, train_size: float, val_size: float, test_size: float):
if train_size + val_size + test_size != 1:
raise ValueError("Train, val and test sizes must sum to 1")
if len(input_keys) == 0:
raise ValueError("Input keys list is empty")
items_by_use = dict()
for input_key in tqdm(input_keys):
try:
user_id = get_cycles_collection().find_one({"_id": ObjectId(input_key)})["user_id"]
if user_id not in items_by_use:
items_by_use[user_id] = []
items_by_use[user_id].append(input_key)
except Exception:
print(f"Error getting user id for key {input_key}")
continue
user_ids = list(items_by_use.keys())
random.shuffle(user_ids)
train_users, temp_users = train_test_split(user_ids, train_size=train_size, test_size=test_size + val_size)
# compute relative test size, as it must be relative to the remaining users
relative_test_size = test_size / (1 - train_size)
val_users, test_users = train_test_split(temp_users, test_size=relative_test_size)
train_keys = []
val_keys = []
test_keys = []
for user_id in train_users:
train_keys.extend(items_by_use[user_id])
for user_id in val_users:
val_keys.extend(items_by_use[user_id])
for user_id in test_users:
test_keys.extend(items_by_use[user_id])
return train_keys, val_keys, test_keys
def save_splits(train_keys: list, val_keys: list, test_keys: list, base_dir: str):
if not os.path.exists(base_dir):
os.makedirs(base_dir)
with open(f"{base_dir}/train_keys.pickle", "wb") as f:
pickle.dump(train_keys, f)
with open(f"{base_dir}/val_keys.pickle", "wb") as f:
pickle.dump(val_keys, f)
with open(f"{base_dir}/test_keys.pickle", "wb") as f:
pickle.dump(test_keys, f)
def load_splits(base_dir: str):
with open(f"{base_dir}/train_keys.pickle", "rb") as f:
train_keys = pickle.load(f)
with open(f"{base_dir}/val_keys.pickle", "rb") as f:
val_keys = pickle.load(f)
with open(f"{base_dir}/test_keys.pickle", "rb") as f:
test_keys = pickle.load(f)
return train_keys, val_keys, test_keys
def get_data_ids(model_configuration: dict,
training_configuration: dict,
env_path: str,
limit: int = None) -> tuple:
env = lmdb.open(f"{env_path}", readonly=True)
if os.path.exists(f"{model_configuration['feature_config']['dataset_dir']}/train_keys.pickle"):
train_ids, val_ids, test_ids = load_splits(model_configuration["feature_config"]["dataset_dir"])
else:
lmdb_keys = get_lmdb_keys(env, limit)
# train_ids, val_ids, test_ids = get_splits_by_user(lmdb_keys,
# training_configuration["train_size"],
# training_configuration["val_size"],
# training_configuration["test_size"])
train_ids, temp_ids = train_test_split(lmdb_keys,
train_size=training_configuration["train_size"],
test_size=training_configuration["val_size"] + training_configuration[
"test_size"])
# compute relative test size, as it must be relative to the remaining users
relative_test_size = training_configuration["test_size"] / (1 - training_configuration["train_size"])
val_ids, test_ids = train_test_split(temp_ids,
test_size=relative_test_size)
# save splits to file
save_splits(train_ids, val_ids, test_ids, model_configuration["feature_config"]["dataset_dir"])
if limit is not None:
train_size = training_configuration["train_size"]
val_size = training_configuration["val_size"]
test_size = training_configuration["test_size"]
train_lim = int(limit * train_size)
val_lim = int(limit * val_size)
test_lim = int(limit * test_size)
train_ids = train_ids[:train_lim]
val_ids = val_ids[:val_lim]
test_ids = test_ids[:test_lim]
return train_ids, val_ids, test_ids
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import sys
import inspect
import hashlib
import logging
from functools import partial
import random
from typing import Callable
import importlib
import numpy as np
def get_logger(module_name: str, filename: str = "main.log") -> logging.Logger:
"""
Returns a logger for the given module name and filename.
:param module_name: name of the module, as string
:param filename: name of the logging file, as string
:return: the logger, as logging.Logger object
"""
logger = logging.getLogger(module_name)
logger.setLevel(logging.DEBUG)
logger.propagate = False
formatter = logging.Formatter('%(asctime)s - %(name)s - %(levelname)s - %(message)s')
file_handler = logging.FileHandler(filename)
file_handler.setLevel(logging.DEBUG)
file_handler.setFormatter(formatter)
logger.addHandler(file_handler)
# add system out handler
stream_handler = logging.StreamHandler(sys.stdout)
stream_handler.setLevel(logging.INFO)
stream_handler.setFormatter(formatter)
logger.addHandler(stream_handler)
return logger
def get_variable_from_module(module_path: str, variable_name: str):
"""
Get a variable from a module by its name during runtime
Args:
module_path: module to fetch variable from
variable_name: variable to fetch from module
Returns:
variable from module
"""
module = importlib.import_module(module_path)
variable = getattr(module, variable_name)
if variable is None:
raise ValueError(f"Variable {variable_name} not found in module {module_path}")
return variable
def get_callable_name(callable_obj):
"""
Get the name of the callable, handling `functools.partial`.
:param callable_obj: callable object
:return: name of the callable
"""
if isinstance(callable_obj, partial):
func_name = callable_obj.func.__name__
args = ", ".join(object_to_string(arg) for arg in callable_obj.args)
kwargs = ", ".join(f"{object_to_string(k)}={object_to_string(v)!r}" for k, v in callable_obj.keywords.items())
return f"partial({func_name}, {args}, {kwargs})"
else:
if hasattr(callable_obj, '__name__'):
return callable_obj.__name__
elif hasattr(callable_obj, '__class__'):
return callable_obj.__class__.__name__
elif hasattr(callable_obj, '__hash__'):
return callable_obj.__hash__
else:
raise ValueError(f"Could not determine name of callable object {callable_obj}")
def object_to_string(value, skip_types=None):
"""
Convert any object to a string representation that avoids memory addresses.
Handles complex data types recursively.
:param value: object to convert
:param skip_types: types to skip during conversion
:return: string representation of the object
"""
if skip_types is None:
skip_types = []
if any(isinstance(value, t) for t in skip_types):
return 'skipped_type'
elif isinstance(value, (str, int, float, bool)): # Handle primitive data types directly
return repr(value)
elif isinstance(value, dict):
return '{' + ', '.join(f"{k}: {object_to_string(v, skip_types)}" for k, v in value.items()) + '}'
elif isinstance(value, (list, tuple)):
return '[' + ', '.join(object_to_string(item, skip_types) for item in value) + ']'
elif isinstance(value, partial):
return get_callable_name(value)
elif inspect.isclass(value):
return f"<class '{value.__name__}'>"
elif hasattr(value,
'__class__') and not value.__class__ != "function": # Correct handling for instances of classes, but not functions
return f"<instance of class '{value.__class__.__name__}'>"
elif isinstance(value, Callable):
return f"<callable '{get_callable_name(value)}'>"
else:
return repr(value)
def get_config_id(configuration: dict) -> str:
"""
Generate a somewhat unique human-readable model name from the model and training parameters.
:param configuration: dictionary containing model and training parameters
:return: human-readable model name
"""
adjectives = ["autumn", "hidden", "bitter", "misty", "silent", "empty", "dry", "dark", "summer", "icy", "delicate",
"quiet", "white", "black", "blue", "green", "red", "yellow",
"purple", "orange", "pink", "golden", "silver", "crimson", "violet", "azure", "amber", "sapphire",
"emerald", "ruby", "pearl", "topaz", "onyx", "turquoise", "citrine", ]
nouns = ["waterfall", "river", "breeze", "moon", "rain", "wind", "sea", "morning", "snow", "lake", "sunset", "pine",
"shadow", "leaf", "dawn", "glitter", "forest", "cloud", "sky", "sun", "butterfly",
"flower", "bird", "mountain", "valley", "ocean", "star", "night", "dream", "whisper", "echo", "horizon",
"wave", "petal", "dew", "mist"]
# also add dataset config, but skip functions
base_name = object_to_string(configuration)
# hash long name
basename_hash = hashlib.md5(base_name.encode()).hexdigest()
# select adjective and noun based on hash
random.seed(int(basename_hash, 16))
model_name = f"{random.choice(adjectives)}_{random.choice(nouns)}_{basename_hash[:5]}"
return model_name
def convert_for_json(obj):
if isinstance(obj, dict):
return {k: convert_for_json(v) for k, v in obj.items()}
elif isinstance(obj, list):
return [convert_for_json(v) for v in obj]
elif isinstance(obj, np.generic):
return obj.item()
else:
return obj
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import numpy as np
import torch
from torch import nn
from utils.dataset_creation import inverse_scale_feature
def plot_prediction_windows(index: int,
training_configuration: dict,
item_x: np.ndarray,
item_y: np.ndarray,
preds: np.ndarray,
scalers: dict,
features_to_plot: list,
output_feature_names: list,
fig_widget):
window_features = item_x[index]
indices = np.arange(window_features.shape[0])
actual = item_y[index].ravel()
predicted = preds[index]
# clear previous traces
fig_widget.data = []
for feature in features_to_plot:
feature_index = feature["index"]
feature_name = feature["name"]
fig_widget.add_scatter(
x=indices,
y=window_features[:, feature_index],
mode="lines",
name=feature_name,
)
num_outputs = predicted.shape[-1]
scaled_preds = list()
for i in range(num_outputs):
if isinstance(training_configuration["loss_functions"][i], nn.BCEWithLogitsLoss):
output = torch.sigmoid(torch.tensor(predicted[i]))
else:
output = predicted[i]
output = float(output)
scaled_output = inverse_scale_feature(output,
output_feature_names[i],
scalers)
scaled_preds.append(scaled_output)
scaled_actuals = list()
for i in range(num_outputs):
output = float(actual[i].numpy())
scaled_output = inverse_scale_feature(output,
output_feature_names[i],
scalers)
scaled_actuals.append(scaled_output)
# add actual and predicted values
print(f"actual: {scaled_actuals}, predicted: {scaled_preds}")