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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