[gmx-users] extrnal itp files
bhf70
bhf70 at uni.udm.ru
Mon Feb 16 11:07:08 CET 2009
It is possible to set an example ?
bhf70 wrote:
> Could you tell me, please.
>
> What's directions need the programm pdb2gmx to use external .itp files,
> for example martini_v2.1.itp (Coarse Grained Force Field)?
>
> How is it to do ?
There should be instructions accompanying that force field wherever you
got it from.
There's some general information here
http://wiki.gromacs.org/index.php/Include_File_Mechanism
Mark
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