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| author | asau <asau@pkgsrc.org> | 2011-03-23 05:36:29 +0000 |
|---|---|---|
| committer | asau <asau@pkgsrc.org> | 2011-03-23 05:36:29 +0000 |
| commit | 63d1aba073fc52c3d6f969fbe4d8e0e6725f937e (patch) | |
| tree | 5206847b30362c14a19ab12595c4cdf3647d94fe /devel/cvs2cl | |
| parent | 3db65362dbfe37b695164bbf9a98463f063ee426 (diff) | |
| download | pkgsrc-63d1aba073fc52c3d6f969fbe4d8e0e6725f937e.tar.gz | |
Update to Gromacs 4.5.4:
* Fixed pdb2gmx picking up force field from local instead of
library directory
* Made pdb2gmx vsite generation work again for certain His namings.
* Fixed incorrect virial and pressure averages with certain
nst... values (instantaneous values correct)
* Fixed incorrect cosine viscosity output
* New -multidir alternative for mdrun -multi option
* Several minor fixes in analysis tools
* Several updates to the program documentation
Diffstat (limited to 'devel/cvs2cl')
0 files changed, 0 insertions, 0 deletions