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  1. xuhuihuang/featuredock xuhuihuang/featuredock Public

    FeatureDock is a protein-ligand docking software guided by physicochemical feature-based local environment learning using Transformer

    Jupyter Notebook 37 10

  2. xuhuihuang/mlchem xuhuihuang/mlchem Public

    Jupyter Notebook Tutorials for Machine Learning in Chemistry (MLChem)

    Jupyter Notebook 10 3