[gmx-users] Covariance analysis for CONCOORD results
Anton Feenstra
feenstra at chem.vu.nl
Wed Dec 11 13:34:31 CET 2002
Bert de Groot wrote:
> Ruben Martinez Buey wrote:
[...]
> > g_covar ask for a .tpr file
>
> you can just as well take a .pdb or .gro file (e.g. dist.pdb)
It says so in the help:
# g_covar -h
[...]
-s topol.tpr Input Structure+mass(db): tpr tpb tpa gro g96 pdb
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
--
Groetjes,
Anton
________ ___________________________________________________________
| | Anton Feenstra |
| . | Dept. of Pharmacochemistry - Vrije Universiteit Amsterdam |
| |---- | De Boelelaan 1083 - 1081 HV Amsterdam - The Netherlands |
| |---- | Tel: +31 20 44 47608 - Fax: +31 20 44 47610 |
| ' __ | Feenstra at chem.vu.nl - http://www.chem.vu.nl/afdelingen/FAR|
| / \ |-----------------------------------------------------------|
| ( ) | Dept. of Biophysical Chemistry - University of Groningen |
| \__/ | Nijenborgh 4 - 9747 AG Groningen - The Netherlands |
| __ | Tel +31 50 363 4327 - Fax +31 50 363 4800 |
| / \ | K.A.Feenstra at chem.rug.nl - http://md.chem.rug.nl/~anton |
| ( ) |-----------------------------------------------------------|
| \__/ | "Hmm, It *Does* Go Well With the Chicken" (Beastie Boys) |
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