User guide#

This guide provides

  • material introducing GROMACS

  • practical advice for making effective use of GROMACS.

For getting, building and installing GROMACS, see the Installation guide. For background on algorithms and implementations, see the reference manual part of the documentation. If you have questions not answered by these resources, please visit the GROMACS users forum and search for a potential answer or ask a question from the community.

Please reference this documentation as

To cite the source code for this release, please cite