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Popular repositories

  1. deepFMPOv3D deepFMPOv3D Public

    Forked from giovanni-bolcato/deepFMPOv3D

    Implementation of Shape and Electrostatic similarity metric in deepFMPO.

    Python 1

  2. TIES_MD TIES_MD Public

    Forked from UCL-CCS/TIES_MD

    Python package built on OpenMM and OpenMMTools to perform binding free energy calculations using the TIES protocol.

    Python 1

  3. InteractionGraphNet InteractionGraphNet Public

    Forked from zjujdj/InteractionGraphNet

    InteractionGraphNet: a Novel and Efficient Deep Graph Representation Learning Framework for Accurate Protein-Ligand Interaction Prediction and Large-scale Structure-based Virtual Screening

  4. GENTRL GENTRL Public

    Forked from Bibyutatsu/GENTRL

    Generative Tensorial Reinforcement Learning (GENTRL) model

    Python

  5. liGAN liGAN Public

    Forked from mattragoza/LiGAN

    Deep generative models of 3D grids for structure-based drug discovery

    Python

  6. KinFragLib KinFragLib Public

    Forked from volkamerlab/KinFragLib

    Kinase-focused fragment library

    Jupyter Notebook