Key | Value |
---|---|
FileName | ./usr/bin/mdrun_mpi |
FileSize | 9264812 |
MD5 | C2D50BC35F53163DCD71CFE7F8036B9D |
SHA-1 | 5D1AE4FCB6F4B07E19D02F1F13CA9C36256A4BFB |
SHA-256 | 106020D53B774904EAF19B07BD4CE45CA960D21F17BF1CA8481A1ABCCEB01816 |
SSDEEP | 196608:5La7AJ4OjtRliZCc+aq0fogjo8E/ByEM8NwhiY55XtR1iHDJJvt87i12477rOzK6:5a7AJrjtRliZCc+aqtOot/Byx3cK1qvC |
TLSH | T150965B50EFE9A6A0EA930CF0211F6579D4303E274013B1F7EBD42E54EDA2B984536AD7 |
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 | 6364996 |
MD5 | 84F4EC77781A5991FE236AED61AF2C09 |
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 | 7215280A8EE4BE4B319363EAFCA260C4F779312F |
SHA-256 | A127C9E41AC540417DF4B9E8455D67DEE725A76C9288AFD5E1AA65AAE4A9BC67 |