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jewettaij
moltemplate jewettaij
100
262
mit
14
A general cross-platform tool for preparing simulations of molecules and complex molecular assemblies
opls amber lammps lammps-data lammps-tool force-fields open-science molecule-editor molecule-builder molecular-dynamics lammps-script-creator coarse-grained-molecular-dynamics
Created 2016-12-01
990 commits to master branch, last one 11 days ago
Isra3l
ligpargen Isra3l
23
60
mit
4
This repository has no description...
cm1a opls opls-aa molecular-dynamics monte-carlo-simulation molecular-dynamics-simulation alchemical-free-energy-calculations
Created 2021-01-13
44 commits to main branch, last one 3 days ago