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  1. openmm-deepmd openmm-deepmd Public

    OpenMM plugin to use DeepMD-kit force field

    C++ 3 1

  2. openmm-customtools openmm-customtools Public

    Some CustomBond and CustomIntegrator classes for collective varible defining and enhanced sampling

    Python 2 1

  3. i-pi-driver i-pi-driver Public

    Socket client for i-PI package

    Python 8 3

  4. chainofstate chainofstate Public

    Chain-of-state Methods

    Python

  5. EVB EVB Public

    Empirical valance bond method to hybrid multiple PES

    Python 4

  6. openmm-chargeflux openmm-chargeflux Public

    C++ 1