FileSize | 137088 |
MD5 | 785C230E4436E9C24261858CCB40E47B |
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 | 2020.6-2 |
SHA-1 | 2A7D2AFB2E74C16B5C6659D4F7E3EF98DE72DCBE |
SHA-256 | 4892780799C4BB991E062F6764710566324750D378024B40B2F3A2E61223CFCB |