[gmx-users] mdrun -v output

Peter C. Lai pcl at uab.edu
Mon Jun 18 22:57:35 CEST 2012


It actually depends on your shell/environment :-P

On sun grid engine and derivatives, the you can have the scheduler capture
the stdout and stderr output through the -o and -e parameters, respectively.

On 2012-06-18 05:28:11PM +0530, Chandan Choudhury wrote:
> On Mon, Jun 18, 2012 at 12:43 PM, Javier Cerezo <jcb1 at um.es> wrote:
> 
> >  Information messages, such as those shown on the screen during mdrun are
> > output to stderr. So if you want to get them you should redirect as follows:
> >
> > mdrun -v -s md.tpr 2> verbose.txt
> >
> > In the case where you may need to get all output (from both stdout and
> > stderr) you should use:
> >
> > mdrun -v -s md.tpr &> verbose.txt
> >
> 
> Thanks. It is actually  mdrun -v -s md.tpr >& verbose.txt
> 
> >
> > Javier
> >
> > El 18/06/12 08:49, Chandan Choudhury escribió:
> >
> >
> > Dear gmx users,
> >
> > Is it possible to redirect the output of mdrun -v to a file while
> > submitting the job using pbs script?
> >  mdrun -v -s md.tpr > verbose.txt
> > donot produce output (to file verbose.txt) while the job is running.
> >
> > Chandan
> >
> > --
> > Chandan kumar Choudhury
> > NCL, Pune
> > INDIA
> >
> >
> >
> > --
> > Javier CEREZO BASTIDA
> > PhD Student
> > Physical Chemistry
> > Universidad de Murcia
> > Murcia (Spain)
> > Tel: (+34)868887434
> >
> > --
> > gmx-users mailing list    gmx-users at 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!
> > 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/Support/Mailing_Lists
> >

> -- 
> gmx-users mailing list    gmx-users at 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!
> 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/Support/Mailing_Lists


-- 
==================================================================
Peter C. Lai			| University of Alabama-Birmingham
Programmer/Analyst		| KAUL 752A
Genetics, Div. of Research	| 705 South 20th Street
pcl at uab.edu			| Birmingham AL 35294-4461
(205) 690-0808			|
==================================================================




More information about the gromacs.org_gmx-users mailing list