MolProp

Contents:

Introduction
Single Model Training
K-Fold Cross Validation
Ensemble Training

MolProp:

molprop
tests

MolProp

molprop
molprop.training_type
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molprop.training_type

Defines the enum ‘TrainingType’.

Classes

Defines the type to train a model.

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© Copyright 2022, Jan G. Rittig, Malte Frank, Moritz Wedemeyer.

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