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robraddi/README.md

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  1. vvoelz/biceps vvoelz/biceps Public

    Bayesian inference of conformational populations

    Python 13 3

  2. vvoelz/pylambdaopt vvoelz/pylambdaopt Public

    Python scripts and module to optimize lambda values in alchemical free energy calculations

    Python 4

  3. GP-SAMPL7 GP-SAMPL7 Public

    Stacking Gaussian Processes to Improve pKa Predictions in the SAMPL7 Challenge

    Jupyter Notebook 5 1

  4. vvoelz/HPSandbox vvoelz/HPSandbox Public

    a package of Python modules and example scripts for experimenting with the two-dimensional HP lattice model of Dill and Chan.

    Python 9 4

  5. SymPyVolume SymPyVolume Public

    Command line 3-D Plotting tool derived from SymPy and IPyVolume

    HTML 1

  6. Wiki-Organizer Wiki-Organizer Public

    Wiki-Organizer is a very basic GitHub Action that automatically generates a Home.md for a GitHub wiki

    Python