2 results found Sort:

Valdes-Tresanco-MS
gmx_MMPBSA Valdes-Tresanco-MS
68
234
gpl-3.0
9
gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.
gmx mmgbsa mmpbsa gromacs ambertools gmx-mmgbsa gmx-mmpbsa energy-calculations
Created 2020-09-13
2,153 commits to master branch, last one about a month ago
IFMlab
ChemFlow IFMlab
4
54
unknown
1
Computational Chemistry Workflows
mmgbsa mmpbsa docking workflow middleware scoring-functions computational-science computational-chemistry
Created 2017-07-28
875 commits to master branch, last one 2 years ago