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malramsay64 / statdyn-analysis

Collection of tools for the statistical dynamics analysis of Molecular Dynamics trajectories.
MIT License
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Test output of comp_dynamics as input for comp_relaxations #41

Closed malramsay64 closed 6 years ago

malramsay64 commented 6 years ago

The comp_relaxations takes the output of comp_dynamics and processes it. There should be a test to ensure this process is seamless because it is currently broken.