Package: gromacs-lam (4.0.4-1) [debports]

[ Source: gromacs  ]

Molecular dynamics sim, binaries for LAM-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 LAM-MPI interface. It is suitable for nodes of a processing cluster, or for multiprocessor machines.

Other Packages Related to gromacs-lam

• dep: lam-runtime (>= 7.0)

  LAM runtime environment for executing parallel programs

• dep: libc6 (>= 2.5-5)

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

• dep: libfftw3-3

  library for computing Fast Fourier Transforms

• dep: liblam4

  Shared libraries used by LAM parallel programs

• rec: gromacs

  Molecular dynamics simulator, with building and analysis tools

• sug: gromacs-data

  GROMACS molecular dynamics sim, data and documentation

Download gromacs-lam

Download for all available architectures

Architecture	Package Size	Installed Size	Files
m68k (unofficial port)	1,943.0 kB	6,380.0 kB	[list of files]