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Achievement: Pull Sharkx2Achievement: Arctic Code Vault Contributor

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  1. leeping/forcebalance leeping/forcebalance Public

    Systematic force field optimization.

    Python 146 75

  2. openforcefield/openforcefield-forcebalance openforcefield/openforcefield-forcebalance Public

    Optimization of OpenFF parameters using ForceBalance and QCArchive

    Python 11 5

  3. lpwgroup/respyte lpwgroup/respyte Public

    Implementation of open-source version of RESP method

    Python 5 5