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  1. deepchem Public

    Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

    Python 3.6k 1.3k

  2. Example code from the book "Deep Learning for the Life Sciences"

    Jupyter Notebook 247 120

  3. jaxchem Public

    JAXChem is a JAX-based deep learning library for complex and versatile chemical modeling

    Python 63 8

  4. Moleculenet.ai Datasets And Splits

    Jupyter Notebook 58 14

  5. A simple web GUI for DeepChem

    JavaScript 47 16

  6. An experimental repo for experimenting with PyTorch models

    Python 32 12

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