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choderalab
pymbar choderalab
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Python implementation of the multistate Bennett acceptance ratio (MBAR)
mbar pymbar python research equilibrium free-energies thermodynamic-states single-molecule-pulling bennett-acceptance-ratio extended-bridge-sampling molecular-dynamics-simulations multistate-bennett-acceptance-ratio
Created 2013-05-10
1,045 commits to master branch, last one about a month ago