WenjieDu/PyPOTS

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pypots/classification/brits/model.py

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"""
The implementation of BRITS for the partially-observed time-series classification task.

"""

# Created by Wenjie Du <wenjay.du@gmail.com>
# License: BSD-3-Clause

from typing import Optional, Union

import numpy as np
import torch
from torch.utils.data import DataLoader

from .core import _BRITS
from .data import DatasetForBRITS
from ..base import BaseNNClassifier
from ...optim.adam import Adam
from ...optim.base import Optimizer


class BRITS(BaseNNClassifier):
    """The PyTorch implementation of the BRITS model :cite:`cao2018BRITS`.

    Parameters
    ----------
    n_steps :
        The number of time steps in the time-series data sample.

    n_features :
        The number of features in the time-series data sample.

    n_classes :
        The number of classes in the classification task.

    rnn_hidden_size :
        The size of the RNN hidden state.

    classification_weight :
        The loss weight for the classification task.

    reconstruction_weight :
        The loss weight for the reconstruction task.

    batch_size :
        The batch size for training and evaluating the model.

    epochs :
        The number of epochs for training the model.

    patience :
        The patience for the early-stopping mechanism. Given a positive integer, the training process will be
        stopped when the model does not perform better after that number of epochs.
        Leaving it default as None will disable the early-stopping.

    optimizer :
        The optimizer for model training.
        If not given, will use a default Adam optimizer.

    num_workers :
        The number of subprocesses to use for data loading.
        `0` means data loading will be in the main process, i.e. there won't be subprocesses.

    device :
        The device for the model to run on. It can be a string, a :class:`torch.device` object, or a list of them.
        If not given, will try to use CUDA devices first (will use the default CUDA device if there are multiple),
        then CPUs, considering CUDA and CPU are so far the main devices for people to train ML models.
        If given a list of devices, e.g. ['cuda:0', 'cuda:1'], or [torch.device('cuda:0'), torch.device('cuda:1')] , the
        model will be parallely trained on the multiple devices (so far only support parallel training on CUDA devices).
        Other devices like Google TPU and Apple Silicon accelerator MPS may be added in the future.

    saving_path :
        The path for automatically saving model checkpoints and tensorboard files (i.e. loss values recorded during
        training into a tensorboard file). Will not save if not given.

    model_saving_strategy :
        The strategy to save model checkpoints. It has to be one of [None, "best", "better", "all"].
        No model will be saved when it is set as None.
        The "best" strategy will only automatically save the best model after the training finished.
        The "better" strategy will automatically save the model during training whenever the model performs
        better than in previous epochs.
        The "all" strategy will save every model after each epoch training.

    verbose :
        Whether to print out the training logs during the training process.
    """

    def __init__(
        self,
        n_steps: int,
        n_features: int,
        n_classes: int,
        rnn_hidden_size: int,
        classification_weight: float = 1,
        reconstruction_weight: float = 1,
        batch_size: int = 32,
        epochs: int = 100,
        patience: Optional[int] = None,
        optimizer: Optional[Optimizer] = Adam(),
        num_workers: int = 0,
        device: Optional[Union[str, torch.device, list]] = None,
        saving_path: str = None,
        model_saving_strategy: Optional[str] = "best",
        verbose: bool = True,
    ):
        super().__init__(
            n_classes,
            batch_size,
            epochs,
            patience,
            num_workers,
            device,
            saving_path,
            model_saving_strategy,
            verbose,
        )

        self.n_steps = n_steps
        self.n_features = n_features
        self.rnn_hidden_size = rnn_hidden_size
        self.classification_weight = classification_weight
        self.reconstruction_weight = reconstruction_weight

        # set up the model
        self.model = _BRITS(
            self.n_steps,
            self.n_features,
            self.rnn_hidden_size,
            self.n_classes,
            self.classification_weight,
            self.reconstruction_weight,
        )
        self._send_model_to_given_device()
        self._print_model_size()

        # set up the optimizer
        self.optimizer = optimizer
        self.optimizer.init_optimizer(self.model.parameters())

    def _assemble_input_for_training(self, data: list) -> dict:
        # fetch data
        (
            indices,
            X,
            missing_mask,
            deltas,
            back_X,
            back_missing_mask,
            back_deltas,
            label,
        ) = self._send_data_to_given_device(data)

        # assemble input data
        inputs = {
            "indices": indices,
            "label": label,
            "forward": {
                "X": X,
                "missing_mask": missing_mask,
                "deltas": deltas,
            },
            "backward": {
                "X": back_X,
                "missing_mask": back_missing_mask,
                "deltas": back_deltas,
            },
        }
        return inputs

    def _assemble_input_for_validating(self, data: list) -> dict:
        return self._assemble_input_for_training(data)

    def _assemble_input_for_testing(self, data: list) -> dict:
        # fetch data
        (
            indices,
            X,
            missing_mask,
            deltas,
            back_X,
            back_missing_mask,
            back_deltas,
        ) = self._send_data_to_given_device(data)

        # assemble input data
        inputs = {
            "indices": indices,
            "forward": {
                "X": X,
                "missing_mask": missing_mask,
                "deltas": deltas,
            },
            "backward": {
                "X": back_X,
                "deltas": back_deltas,
                "missing_mask": back_missing_mask,
            },
        }
        return inputs

    def fit(
        self,
        train_set: Union[dict, str],
        val_set: Optional[Union[dict, str]] = None,
        file_type: str = "hdf5",
    ) -> None:
        # Step 1: wrap the input data with classes Dataset and DataLoader
        training_set = DatasetForBRITS(train_set, file_type=file_type)
        training_loader = DataLoader(
            training_set,
            batch_size=self.batch_size,
            shuffle=True,
            num_workers=self.num_workers,
        )
        val_loader = None
        if val_set is not None:
            val_set = DatasetForBRITS(val_set, file_type=file_type)
            val_loader = DataLoader(
                val_set,
                batch_size=self.batch_size,
                shuffle=False,
                num_workers=self.num_workers,
            )

        # Step 2: train the model and freeze it
        self._train_model(training_loader, val_loader)
        self.model.load_state_dict(self.best_model_dict)
        self.model.eval()  # set the model as eval status to freeze it.

        # Step 3: save the model if necessary
        self._auto_save_model_if_necessary(confirm_saving=self.model_saving_strategy == "best")

    def predict(
        self,
        test_set: Union[dict, str],
        file_type: str = "hdf5",
    ) -> dict:
        self.model.eval()  # set the model as eval status to freeze it.
        test_set = DatasetForBRITS(test_set, return_y=False, file_type=file_type)
        test_loader = DataLoader(
            test_set,
            batch_size=self.batch_size,
            shuffle=False,
            num_workers=self.num_workers,
        )
        classification_collector = []

        with torch.no_grad():
            for idx, data in enumerate(test_loader):
                inputs = self._assemble_input_for_testing(data)
                results = self.model.forward(inputs, training=False)
                classification_pred = results["classification_pred"]
                classification_collector.append(classification_pred)

        classification = torch.cat(classification_collector).cpu().detach().numpy()
        result_dict = {
            "classification": classification,
        }
        return result_dict

    def classify(
        self,
        test_set: Union[dict, str],
        file_type: str = "hdf5",
    ) -> np.ndarray:
        """Classify the input data with the trained model.

        Parameters
        ----------
        test_set :
            The data samples for testing, should be array-like of shape [n_samples, sequence length (n_steps),
            n_features], or a path string locating a data file, e.g. h5 file.

        file_type :
            The type of the given file if X is a path string.

        Returns
        -------
        array-like, shape [n_samples],
            Classification results of the given samples.
        """

        result_dict = self.predict(test_set, file_type=file_type)
        return result_dict["classification"]