FileSize | 138056 |
MD5 | 1EAA768C040FF4A90B74F9F69FD1A6E1 |
PackageDescription | Molecular dynamics simulator, with building and analysis tools
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. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | gromacs |
PackageSection | science |
PackageVersion | 2021.4-2 |
SHA-1 | 477F0C79777C5730696335A1EF6991487D7F443E |
SHA-256 | F53BADC8743DE2DE865E83FA4D3C865F9CFC2807BF6FD726592D08EDD6386E4F |