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시리즈: AI for Chemistry python 22 줄 · 업데이트 2026-02-11

__init__.py

AI for Chemistry/code/chemprop_VP-main (1)/chemprop_VP-main/chemprop/train/__init__.py

from .cross_validate import chemprop_train, cross_validate, TRAIN_LOGGER_NAME
from .evaluate import evaluate, evaluate_predictions
from .make_predictions import chemprop_predict, make_predictions, load_model
from .molecule_fingerprint import chemprop_fingerprint, model_fingerprint
from .predict import predict
from .run_training import run_training
from .train import train

__all__ = [
    'chemprop_train',
    'cross_validate',
    'TRAIN_LOGGER_NAME',
    'evaluate',
    'evaluate_predictions',
    'chemprop_predict',
    'chemprop_fingerprint',
    'make_predictions',
    'load_model',
    'predict',
    'run_training',
    'train'
]

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