OpenPathSampling

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1. openpathsamplingopenpathsamplingPublic

   An open source Python framework for transition interface and path sampling calculations.

   Python 117 53

2. openpathsampling-cliopenpathsampling-cliPublic

   Command line tools for OpenPathSampling

   Python 3 3

3. ops_tutorialops_tutorialPublic

   Introductory tutorial on TPS, committor analysis, and (MS)TIS with OpenPathSampling

   Jupyter Notebook 20 11

4. ops_additional_examplesops_additional_examplesPublic

   Additional examples illustrating various aspects of OpenPathSampling

   Jupyter Notebook 2

5. mini-tutorialsmini-tutorialsPublic

   Small, topic-focused tutorials for OpenPathSampling

   Jupyter Notebook 2