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@GilsonLabUCSD

Gilson Lab (UCSD)

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  1. pAPRika pAPRika Public

    Advanced toolkit for binding free energy calculations

    Python 32 14

  2. APR APR Public

    Attach-release-pull: A free energy calculation workflow

    Python 7 3

  3. Sensitivity-Analysis Sensitivity-Analysis Public

    a force field optimization tool

    C++ 3

  4. Isothermal-Titration-Calorimetry Isothermal-Titration-Calorimetry Public

    Contains code for generating and fitting data for isothermal titration calorimetry

    Python 1 1

  5. SAMPL5-bootstrapping-error-analysis SAMPL5-bootstrapping-error-analysis Public

    Jupyter Notebook 1 1

  6. itc_fit itc_fit Public

    Python 1

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