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[ Quellcode: gromacs  ]

Paket: gromacs (2018.1-1)

Molecular dynamics simulator, with building and analysis tools

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.

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  • dep: gromacs-data (= 2018.1-1)
    GROMACS molecular dynamics sim, data and documentation
  • dep: libc6 (>= 2.14) [amd64]
    GNU C Library: Shared libraries
    auch ein virtuelles Paket, bereitgestellt durch libc6-udeb
    dep: libc6 (>= 2.4) [i386]
  • dep: libgcc1 (>= 1:3.0) [amd64]
    GCC support library
    dep: libgcc1 (>= 1:4.2) [i386]
  • dep: libgromacs3
    GROMACS molecular dynamics sim, shared libraries
  • dep: libstdc++6 (>= 5.2)
    GNU Standard C++ Library v3
  • dep: libx11-6
    X11 client-side library
  • dep: sse2-support [i386]
    prevent installation on processors without required instructions
  • rec: cpp
    GNU C preprocessor (cpp)
  • sug: pymol
    Molecular Graphics System

gromacs herunterladen

Download für alle verfügbaren Architekturen
Architektur Paketgröße Größe (installiert) Dateien
amd64 220,3 kB830 kB [Liste der Dateien]
i386 210,0 kB808 kB [Liste der Dateien]