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  1. Min_Dist_Matrix_Rep Min_Dist_Matrix_Rep Public

    This is the accompanying GitHub for the paper "Can Deep Learning Blind Docking Methods be used to Predict Allosteric Compounds?"

    Jupyter Notebook 5

  2. DiffDock-Fine-Tune DiffDock-Fine-Tune Public

    Forked from gcorso/DiffDock

    Implementation of DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking with Distributed Data Parallel

    Python

  3. SongXia-NYU/drug_discovery_perspective SongXia-NYU/drug_discovery_perspective Public

    Roff 7

  4. echen1214.github.io echen1214.github.io Public

    Eric Chen's Personal Website

    HTML

  5. ml-simplefold-rc ml-simplefold-rc Public

    Forked from apple/ml-simplefold

    Python