FileSize | 125064 |
MD5 | 1AE811B29A9AE7FDD57C2202759539BD |
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 | 59CD1F306D24E861FC7F6E63A047A46914F133C9 |
SHA-256 | FF94E5750A48A092B092F254F1F8A67C423024EBC3B501178D3B2367DDE6312F |