FileSize | 148256 |
MD5 | 989318BE3D20EB6A8FFBD08E5AD8F491 |
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 | 359025B8BF6F4475B49A7710215A7A4DBB9A9F38 |
SHA-256 | C0A724AA5D1D224C49A22BE9E0D0CE10910CCBA361CE6258E2C12592106103DF |