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gromacs - GROMACS - Fast, Free and Flexible Molecular Dynamics
- Description:
GROMACS is a versatile and extremely well optimized package
to perform molecular dynamics computer simulations and
subsequent trajectory analysis. It is developed for
biomolecules like proteins, but the extremely high
performance means it is used also in several other field
like polymer chemistry and solid state physics.
This package provides single and double precision binaries.
The documentation is in the package gromacs-common.
N.B. All binaries have names starting with g_, for example
mdrun has been renamed to g_mdrun.
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