Re: information about simulation speed

From: Josh Vermaas (vermaas2_at_illinois.edu)
Date: Tue Dec 02 2014 - 17:08:55 CST

Grep around for a "Benchmark" line. They are there.
-Josh

On 12/02/2014 05:04 PM, Kshatresh Dutta Dubey wrote:
> Yes, but I found like :
>
> WallClock: 569.721008 CPUTime: 569.721008 Memory: 128.992188 MB,
>
> Can we get information in simulation time like ns/day or ps/day?
>
> On Wed, Dec 3, 2014 at 12:53 AM, Axel Kohlmeyer <akohlmey_at_gmail.com
> <mailto:akohlmey_at_gmail.com>> wrote:
>
> On Tue, Dec 2, 2014 at 5:50 PM, Kshatresh Dutta Dubey
> <kshatresh_at_gmail.com <mailto:kshatresh_at_gmail.com>> wrote:
> > Dear User,
> >
> > Is there any way to get the information about the simulation
> speed in namd?
> > I know some package like amber prints the speed of simulation in
> mdout.
>
> have you looked at the NAMD output???
>
> >
> > Regards
> > Kshatresh
> >
>
>
>
> --
> Dr. Axel Kohlmeyer akohlmey_at_gmail.com <mailto:akohlmey_at_gmail.com>
> http://goo.gl/1wk0
> College of Science & Technology, Temple University, Philadelphia
> PA, USA
> International Centre for Theoretical Physics, Trieste. Italy.
>
>
>
>
> --
> With best regards
> ************************************************************************************************
> Kshatresh Dutta Dubey
> Post Doctoral Researcher,
> Lise Meitner Center for Computational Quantum Chemistry
> Hebrew University of Jerusalem Israel
> Jerusalem, Israel
>
>

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