Mansbach-Lab/deeptimeMSMs
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Work on a series of Markov State Model tutorials modeled on the PyEmma ones but primarily using the deeptime software instead. Still requires pyemma for some visualization, which hopefully I will rectify at some point. To run these tutorials I recommend a conda environment with PyEmma, deeptime, numpy, mdtraj, mdshare, and matplotlib installed, as well as jupyterlab or jupyter notebook.