Key | Value |
---|---|
FileName | ./usr/bin/mdrun_mpi |
FileSize | 4550208 |
MD5 | 3E8CA6B98EF678574C8FE5EDF70EDDF4 |
SHA-1 | D50A0F367AC263D8B9F02289ECF64006F561DBCB |
SHA-256 | BC9A3534FB49E80C9CEED74C5A339386302035B0FFD0AA03249A14F8C719511B |
SSDEEP | 98304:+gmRPo4D9CmNRJD8RTR2YTi4ypQPEOo2g:RmRQ4D9CmNX89oYTlypQP1g |
TLSH | T1E6260191E3330A65D6D1E93E7A8626003D01E5A572F5DCC9A8C4C6EA33DF920437B7AD |
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 | 3393356 |
MD5 | A01EF97B6DC1000707616B04ADBE6C2C |
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 | 0B7C2C81900DDAEED0B924E8B9D9EAA8B33BBD4C |
SHA-256 | E3AFDC33626EF25F151D16F7690F2696D7449053083E86399C5A851F7991D025 |