Tim Hempel's repositories
adaptivemd
A python framework to run adaptive Markov state model (MSM) simulation on HPC resources
drunken-markov
Markov state model analysis and estimation pipeline
Language:Jupyter NotebookCC-BY-4.0000
mdshare-feedstock
A conda-smithy repository for mdshare.
BSD-3-Clause000
PyEMMA_IPython
PyEMMA Jupyter Notebooks
remd-temperature-generator
Temperature generator for Replica Exchange MD simulations
Language:PHPMIT000
Language:PythonLGPL-3.0000