4 results found Sort:

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 28 days ago
48
206
gpl-3.0
8
OFFICIAL: AnteChamber PYthon Parser interfacE
Created 2017-10-20
661 commits to master branch, last one 2 months ago
38
172
unknown
17
Python interface of cpptraj
Created 2015-02-02
6,118 commits to master branch, last one 4 months ago
Exploring the conformational ensembles of protein-protein complexes with transformer-based generative neural networks
Created 2023-03-25
88 commits to main branch, last one 5 months ago