software:gromacs:gromacs

GROMACS

GROMACS (GROningen MAchine for Chemical Simulations) is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles.

To determine the available versions of GROMACS installed use

$ vpkg_versions gromacs
  • software/gromacs/gromacs.txt
  • Last modified: 2019-08-29 17:26
  • by anita