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This site supports the development work of GROMACS and projects related to it. There are several projects hosted here but most of the users will be interested in the main GROMACS project. Here are some useful links.

Quick Links

Gromacs project page
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Website: www.gromacs.org

About GROMACS

GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. It is primarily designed for biochemical molecules like proteins, lipids and nucleic acids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non-biological systems, e.g. polymers and nanotubes.

Latest projects

  • Gromacs related projects (02/16/2011 09:15 am)

    Projects related to Gromacs but not (yet) part of the core distribution. These are not maintained or supported by the core Gromacs developers.

  • Documentation (01/17/2011 10:34 am)

    Organizing and improving the Gromacs documentation. It mainly involves the manual but extends to man pages, documentation available on the website etc.

  • FEP/MC/Dynamic Topologies (01/06/2011 04:47 pm)
  • Benchmark suite (01/05/2011 01:57 pm)

    Automated benchmarking system

  • Regression tests suite (01/05/2011 01:54 pm)

    System for automated testing of Gromacs features