Key | Value |
---|---|
FileName | ./usr/bin/mdrun_mpi |
FileSize | 9258872 |
MD5 | 93F01E89E8011DEF16697370120615ED |
SHA-1 | 64EE02EE5A9101FCF98ADD60065300C61E25675E |
SHA-256 | A0F6A601ABFEC34C7FCF84A269337756BD70BAE32F7D738FAB79DF7D678CF8DF |
SSDEEP | 196608:WmAPEmiZoZQWSj8+SykPatIX7CxQE7znp1:QPSvp1 |
TLSH | T186963902B5EE94E8C5E78C7062AAF46BF9217412052539F733E05A285F33B141F75EAB |
hashlookup:parent-total | 1 |
hashlookup:trust | 55 |
The searched file hash is included in 1 parent files which include package known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileSize | 7054596 |
MD5 | 876AC22FF1E2A6C3F42FB2F15C88DC08 |
PackageDescription | Molecular dynamics sim, binaries for MPI parallelization 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. . This package contains only the core simulation engine with parallel support using the default MPI interface on the chosen architecture. It is suitable for nodes of a processing cluster, or for multiprocessor machines. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | gromacs-mpi |
PackageSection | science |
PackageVersion | 2021.4-2 |
SHA-1 | 3E518078EAC0EB52AAB26EB3ADCBF3DBEFCD8D85 |
SHA-256 | 3BDC90983C9BAADA1BE69D052AD2F7CE562051621CF36248D8D723E00F381EFF |