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ModelMole

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  1. RFdiffusion RFdiffusion Public

    Forked from RosettaCommons/RFdiffusion

    Code for running RFdiffusion

    Python

  2. pepfunn pepfunn Public

    Forked from novonordisk-research/pepfunn

    Python package for the analysis of natural and modified peptides using a set of modules to study their sequences

    Jupyter Notebook

  3. pynamd pynamd Public

    Forked from radakb/pynamd

    Python Tools for NAMD

    Python

  4. cjson cjson Public

    Chemical JSON tools for MM

    Python

  5. gmx_MMPBSA gmx_MMPBSA Public

    Forked from Valdes-Tresanco-MS/gmx_MMPBSA

    gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.

    Python

  6. GatorAffinity GatorAffinity Public

    Forked from AIDD-LiLab/GatorAffinity

    GatorAffinity: Boosting Protein-Ligand Binding Affinity Prediction with Large-Scale Synthetic Structural Data

    Python

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