[gmx-users] nmrun

Bert de Groot bgroot at gwdg.de
Sat Jun 21 08:05:01 CEST 2003

On Fri, 20 Jun 2003, Mark Fleharty wrote:

> Hello,
> I recently downloaded and installed gromacs-3.1.4-1.i386.rpm, and
> fftw-2.1.3-1.i386.rpm.
> I have been unable to find the nmrun program that is found in the gromacs
> documentation.  I can run the gmxdemo tutor fine.  In addition, g_nmeig,
> g_anaeig, and g_nmens all appear to work fine, I just can't find nmrun.
> Any ideas?

nmrun is now integrated in mdrun. use integrator = nm in the .mdp file.
I thought the docu was updated. Where did you find a reference  to nmrun?


Dr. Bert de Groot

Max Planck Institute for Biophysical Chemistry
Theoretical molecular biophysics group
Am Fassberg 11
37077 Goettingen, Germany

tel: +49-551-2011306, fax: +49-551-2011089

email: bgroot at gwdg.de

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