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Popular repositories

  1. Forked from swails/ParmEd

    Parameter/topology editor and molecular simulator

    Python 1

  2. Forked from choderalab/gbff

    Tools for Bayesian forcefield development


  3. Forked from mdtraj/mdtraj

    A modern, open library for the analysis of molecular dynamics trajectories

    Python 1

  4. Forked from openforcefield/open-forcefield-data

    Datasets for open forcefield parameterization and development

    Jupyter Notebook

  5. Benchmark sets for alchemical free energy calculations

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