MolProp
Contents:
Introduction
Single Model Training
K-Fold Cross Validation
Ensemble Training
MolProp:
molprop
molprop.applicability_domain_methods
molprop.data_processing
molprop.inference
molprop.info
molprop.models
molprop.powertoys
molprop.powertoys.hydra_utils
molprop.powertoys.hydra_utils.compose_hydra_config
molprop.powertoys.hydra_utils.get_latest_model_path
molprop.powertoys.hydra_utils.get_latest_model_path_by_cfg
molprop.powertoys.logging
molprop.powertoys.pathlib_utils
molprop.predict
molprop.pyg_molgraph
molprop.train_ensemble_model
molprop.train_single_model
molprop.training
molprop.training_type
molprop.utils
tests
MolProp
molprop
molprop.powertoys
molprop.powertoys.hydra_utils
molprop.powertoys.hydra_utils.get_latest_model_path_by_cfg
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molprop.powertoys.hydra_utils.get_latest_model_path_by_cfg
molprop.powertoys.hydra_utils.
get_latest_model_path_by_cfg
(
training_type
:
TrainingType
,
cfg
:
DictConfig
,
models_path
:
Path
)
→
Path