[gmx-users] plot rmsd of single atom / residue
Guenter Fritz
guenter.fritz at uni-konstanz.de
Tue Oct 17 18:02:28 CEST 2006
Dear Viswanadham,
I used g_rmsd but did not find out how to select a single atom or
residue. I just got as far as the pre-defined groups in g_rmsd (groups
1-14).
Is there something like a a "sub-option" ?
> You mean you dint find g_rmsd subroutine or you dint know the way to
> use g_rmsd?
>
> On 10/17/06, *Guenter Fritz* < guenter.fritz at uni-konstanz.de
> <mailto:guenter.fritz at uni-konstanz.de>> wrote:
>
> Dear all,
>
> I want to extrat a rmsd of a single atom or specific residue from
> the
> md trajectory. Should be simple but I didn't dind it.
> Thanks,
> Guenter
>
>
> _______________________________________________
> gmx-users mailing list gmx-users at gromacs.org
> <mailto:gmx-users at gromacs.org>
> http://www.gromacs.org/mailman/listinfo/gmx-users
> Please don't post (un)subscribe requests to the list. Use the
> www interface or send it to gmx-users-request at gromacs.org
> <mailto:gmx-users-request at gromacs.org>.
> Can't post? Read http://www.gromacs.org/mailing_lists/users.php
>
>
>
>
> --
> Viswanadham Sridhara,
> Research Assistant,
> Old Dominion University,
> Norfolk, Va-23529.
>
>------------------------------------------------------------------------
>
>_______________________________________________
>gmx-users mailing list gmx-users at gromacs.org
>http://www.gromacs.org/mailman/listinfo/gmx-users
>Please don't post (un)subscribe requests to the list. Use the
>www interface or send it to gmx-users-request at gromacs.org.
>Can't post? Read http://www.gromacs.org/mailing_lists/users.php
>
--
***********************************
Dr. Guenter Fritz
Fachbereich Biologie
Sektion Naturwissenschaften
Universitaet Konstanz
Universitaetsstrasse 10
Postfach M665
D-78457 Konstanz
e-mail: Guenter.Fritz at uni-konstanz.de
http:\\www.biologie.uni-konstanz.de\fritz
Tel.: +49-(0)7531 88 3687
Fax: +49-(0)7531 88 2966
More information about the gromacs.org_gmx-users
mailing list