Package: gromacs (4.0.7-3)

[ Source: gromacs  ]

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, Structural Biology, Chemistry, Implemented in: C, User Interface: Command Line, X Window System, Role: Program, Interface Toolkit: X library, X Window System: Application

Other Packages Related to gromacs

• dep: gromacs-data (= 4.0.7-3)

  GROMACS molecular dynamics sim, data and documentation

• dep: libc6 (>= 2.7)

  Embedded GNU C Library: Shared libraries
  also a virtual package provided by libc6-udeb

• dep: libfftw3-3

  library for computing Fast Fourier Transforms

• dep: libgsl0ldbl (>= 1.9)

  GNU Scientific Library (GSL) -- library package

• dep: libice6 (>= 1:1.0.0)

  X11 Inter-Client Exchange library

• dep: libsm6

  X11 Session Management library

• dep: libx11-6 (>= 0)

  X11 client-side library

• rec: cpp

  De GNU C preprocessor (cpp)

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Architecture	Package Size	Installed Size	Files
armel	4,721.1 kB	16,756.0 kB	[list of files]