MolProp

Contents:

Introduction
Single Model Training
K-Fold Cross Validation
Ensemble Training

MolProp:

molprop
tests

MolProp

tests
tests.test_torch_cuda
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tests.test_torch_cuda

Basic tests for pytorch cuda support.

Functions

`test_create_tensor`
`test_torch_devices`

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

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