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  1. DynamicBind DynamicBind Public

    repo for DynamicBind: Predicting ligand-specific protein-ligand complex structure with a deep equivariant generative model

    Jupyter Notebook 197 43

  2. awsemmd_script awsemmd_script Public

    Jupyter Notebook 4 5

  3. TankBind TankBind Public

    Open source code for TankBind. Galixir Tenchnologies

    Python 150 49

  4. GlpG_Nature_Communication GlpG_Nature_Communication Public

    Code repository for "Energy landscape underlying spontaneous insertion and folding of an alpha-helical transmembrane protein into a bilayer"

    C++ 1

  5. npschafer/openawsem npschafer/openawsem Public

    An implementation of the AWSEM coarse-grained protein folding forcefield in OpenMM

    Python 35 23

  6. awsemmd awsemmd Public

    Forked from adavtyan/awsemmd

    Associated memory, Water mediated, Structure and Energy Model (AWSEM) protein simulation code

    C++