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1. choderalab/protons choderalab/protons Public

   OpenMM testbed for constant-pH methodologies.

   Python 24 13

2. choderalab/bayesian-itc choderalab/bayesian-itc Public

   Python tools for the analysis and modeling of isothermal titration calorimetry (ITC) experiments.

   TeX 5 10

3. choderalab/titrato choderalab/titrato Public

   Titrato (name pending) is a set of tools for analyzing pKa data.

   Python 1

4. choderalab/saltswap choderalab/saltswap Public

   Package to fluctuate the number of counterions in an OpenMM simulation

   Jupyter Notebook 7 3