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[ Bron: gromacs  ]

Pakket: gromacs (3.3.3-2)

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.

GROMACS offers entirely too many features for a brief description to do it justice. A more complete listing is available at <http://www.gromacs.org/content/view/12/176/>.

Tags: Field: Biology, Chemistry, Implemented in: C, User Interface: Command Line, X Window Systeem, Role: Program, Interface Toolkit: X library, X Window Systeem: Application

Andere aan gromacs gerelateerde pakketten

  • depends
  • recommends
  • suggests
  • dep: base-files (>= 4.0.1)
    diverse Debian basisbestanden
  • dep: gromacs-data (= 3.3.3-2)
    GROMACS molecular dynamics sim, data and documentation
  • dep: lesstif2
    OSF/Motif 2.1 implementation released under LGPL
  • dep: libc0.1 (>= 2.7-1) [kfreebsd-amd64, kfreebsd-i386]
    GNU C Bibliotheek: Gedeelde bibliotheken
    Ook een virtueel pakket geboden door: libc0.1-udeb
  • dep: libc6 (>= 2.5-5) [m68k]
    GNU C Bibliotheek: Gedeelde bibliotheken
    Ook een virtueel pakket geboden door: libc6-udeb
    dep: libc6 (>= 2.7-1) [niet alpha, ia64, kfreebsd-amd64, kfreebsd-i386, m68k]
  • dep: libc6.1 (>= 2.7-1) [alpha, ia64]
    GNU C Bibliotheek: Gedeelde bibliotheken
    Ook een virtueel pakket geboden door: libc6.1-udeb
  • dep: libfftw3-3
    library for computing Fast Fourier Transforms
  • dep: libgfortran3 [alpha]
    Runtime library for GNU Fortran applications
  • dep: libice6 (>= 1:1.0.0)
    X11 Inter-Client Exchange library
  • dep: libsm6
    X11 Session Management library
  • dep: libx11-6
    X11 client-side library
  • dep: libxext6
    X11 miscellaneous extension library
  • dep: libxp6
    X Printing Extension (Xprint) client library
  • dep: libxt6
    X11 toolkit intrinsics library
  • rec: cpp
    De GNU C preprocessor (cpp)

gromacs downloaden

Pakket downloaden voor alle beschikbare platforms
Platform Pakketgrootte Geïnstalleerde grootte Bestanden
alpha 7.219,6 kB13844 kB [overzicht]
amd64 6.389,2 kB14660 kB [overzicht]
arm 6.100,3 kB12152 kB [overzicht]
armel 4.339,4 kB14964 kB [overzicht]
hppa 7.340,7 kB13188 kB [overzicht]
i386 5.529,8 kB13840 kB [overzicht]
ia64 10.306,6 kB24512 kB [overzicht]
kfreebsd-amd64 (unofficial port) 6.343,7 kB14472 kB [overzicht]
kfreebsd-i386 (unofficial port) 5.283,1 kB13276 kB [overzicht]
m68k 3.405,7 kB11088 kB [overzicht]
mips 7.422,0 kB15016 kB [overzicht]
mipsel 7.398,4 kB14976 kB [overzicht]
powerpc 5.017,3 kB11644 kB [overzicht]
s390 6.163,3 kB12520 kB [overzicht]
sparc 6.577,6 kB13416 kB [overzicht]