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| author | asau <asau@pkgsrc.org> | 2010-03-15 14:08:49 +0000 |
|---|---|---|
| committer | asau <asau@pkgsrc.org> | 2010-03-15 14:08:49 +0000 |
| commit | 29d1bdfacb547a15ec030ee9fb1c178cc09d7ff7 (patch) | |
| tree | 91cfac1a1319742f4d3cee1344505397f59d7177 /biology/gromacs/DESCR | |
| parent | ae213c3610fc3db7b848e5163e5b95ed3716b1b2 (diff) | |
| download | pkgsrc-29d1bdfacb547a15ec030ee9fb1c178cc09d7ff7.tar.gz | |
Import GROMACS 4.0.7 as biology/gromacs.
From pkgsrc-wip, packaged originally by Peter Ibsen Hansen.
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.
Diffstat (limited to 'biology/gromacs/DESCR')
| -rw-r--r-- | biology/gromacs/DESCR | 10 |
1 files changed, 10 insertions, 0 deletions
diff --git a/biology/gromacs/DESCR b/biology/gromacs/DESCR new file mode 100644 index 00000000000..17d86649e93 --- /dev/null +++ b/biology/gromacs/DESCR @@ -0,0 +1,10 @@ +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, +lipids and nucleic acids 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. |