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Working loading and predicting with pretrained model + Added scaling in "pure" pytorch during forwarding
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from .data_utils import (
load_protein2embedding,
load_cell2embedding,
get_fingerprint,
is_active,
)
from .pytorch_models import (
PROTAC_Predictor,
PROTAC_Model,
train_model,
)
from .sklearn_models import (
train_sklearn_model,
)
from .optuna_utils import (
hyperparameter_tuning_and_training,
hyperparameter_tuning_and_training_sklearn,
)
from .protac_degradation_predictor import (
get_protac_active_proba,
is_protac_active,
)
__version__ = "0.0.1"
__author__ = "Stefano Ribes"