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Paketbeschreibung


Paketnamegromacs-mpich
BeschreibungMolecular dynamics sim, binaries for MPICH parallelization
Archiv/RepositoryOffizielles Ubuntu Archiv lucid (universe)
Version4.0.7-1
Sektionuniverse/science
Prioritätextra
Installierte Größe5332 Byte
Hängt ab vonlibc6 (>= 2.11~20100104-0ubuntu5), libfftw3-3, libmpich2-1.2, mpich2
Empfohlene Paketegromacs
PaketbetreuerUbuntu Developers
Quellegromacs
Paketgröße2319146 Byte
Prüfsumme MD577f425b7abba7da6ee755197cbdc0da8
Prüfsumme SHA1f61f454b8d513166b067f39aa754522743a13807
Prüfsumme SHA256ff0f28c165979c307b8d931a1378dd3034fb69ec3ce25de51fe3c5b82931cd83
Link zum Herunterladengromacs-mpich_4.0.7-1_i386.deb
Ausführliche BeschreibungGROMACS 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 MPICH (v2) interface. It is suitable for nodes of a processing cluster, or for multiprocessor machines.


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