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jdrusso / msm_we

History-augmented Markov analysis of weighted ensemble trajectories.
https://msm-we.readthedocs.io
MIT License
7 stars 7 forks source link

add choice for prmtop #2

Closed jeremyleung521 closed 3 years ago

jeremyleung521 commented 3 years ago

Just a small change to read prmtop!