gromacs

Molecular dynamics simulator, with building and analysis tools
  https://www.gromacs.org/
  3
  2 reviews



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 and lipids 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.
Latest reviews
5
anonimo115 10 years ago

The fastest molecular dynamics program. It includes analysis and properties calculation tools.

4
morozko 10 years ago

4 of 5 stars