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gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.
Created 2020-09-13
2,151 commits to master branch, last one 14 days ago
4
52
unknown
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Computational Chemistry Workflows
Created 2017-07-28
875 commits to master branch, last one 2 years ago