FileSize | 138532 |
MD5 | 310D78CC331ADAFAC784998BA103F1CF |
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 | 07774D80D8E182EAFDBF01ABBEB0F1DD3E926259 |
SHA-256 | 70817C8A18BC65664370C53B9F7DF3F3DA5AAF9177A1021BFB59CD49649C9604 |