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  1. AMPL AMPL Public

    Forked from ATOMScience-org/AMPL

    The ATOM Modeling PipeLine (AMPL) is an open-source, modular, extensible software pipeline for building and sharing models to advance in silico drug discovery.

    Jupyter Notebook

  2. GGMD GGMD Public

    Forked from CBIIT/GGMD

    Python

  3. GGMD_Azure GGMD_Azure Public

    Running GGMD on Azure Machine Learning using data assets

    Python

  4. REINVENT4 REINVENT4 Public

    Forked from MolecularAI/REINVENT4

    AI molecular design tool for de novo design, scaffold hopping, R-group replacement, linker design and molecule optimization.

    Python

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