Key | Value |
---|---|
FileName | ./usr/bin/mdrun_mpi |
FileSize | 9264812 |
MD5 | EB8B5171573165A517968D6A0058CA69 |
SHA-1 | 320A8DCDC2F0E1A7E4BA6D14D0BA1E8D498FE61E |
SHA-256 | 263A0E30AD5ED7822527FD3BD37FFABD4465F1C25C316C035B093FA752B25ACC |
SSDEEP | 196608:I3tlAqF5jZ2dO7zE4UK/8OlSXbxVNGpkln7yP3xZtJiYJsKjJtm1iaL33zGRbYnF:MlPiWzE4UK/kxV37y5ZtJ/JwG6VZ2w7E |
TLSH | T1C7965B50EFF9A6A0EA930CF0211F6569D4703E270013B1F3EBD42E54EDA2B984576AD7 |
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 | 6370288 |
MD5 | 96D8876D9360B09EFE6E8A6B11515A08 |
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 | 2021.3-3 |
SHA-1 | 845D2028CEE68943A89B2E3D9DFD33592BA1EEB7 |
SHA-256 | 48A69FC3B687330EDF8107D6FF39EB1128B0A25B80E84045C0B52D9A47735DA7 |