FileSize | 123964 |
MD5 | 1787385484370A3079790172AB1BA37C |
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 | 2021.3-3 |
SHA-1 | 10435B5371A8A8741E0A36832B870178F53EA365 |
SHA-256 | 1FDEF479D0B644CA84E935313FEBBC9A02CB15F2A91AFE202B59CA7D0476BE79 |