Re: [gmx-users] GMX manually generate topology for residues

2013-11-01 Thread Mark Abraham
They're http://en.wikipedia.org/wiki/C_preprocessor symbols that are
#defined elsewhere in the directory that contains that .rtp file. The
names/symbols probably map to the original force field literature. grep is
your friend.

Mark


On Fri, Nov 1, 2013 at 6:45 AM, charles  wrote:

> i am a newbie to gromacs, trying to generate a new rtp entry for my
> residue.
> Bonds, dihedrals of .rtp file has gb_XX
> what is gb_XX numbers? how can get informations about that?
> How to define those velues for my residues?
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[gmx-users] GMX manually generate topology for residues

2013-10-31 Thread charles
i am a newbie to gromacs, trying to generate a new rtp entry for my 
residue.

Bonds, dihedrals of .rtp file has gb_XX
what is gb_XX numbers? how can get informations about that?
How to define those velues for my residues?
--
gmx-users mailing listgmx-users@gromacs.org
http://lists.gromacs.org/mailman/listinfo/gmx-users
* Please search the archive at 
http://www.gromacs.org/Support/Mailing_Lists/Search before posting!
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