[gmx-users] calculating total percentage of time from gibbs free energy landscape

Johnny Lu johnny.lu128 at gmail.com
Sun Sep 13 15:24:43 CEST 2015


can the following work?
http://unix.stackexchange.com/questions/12068/how-to-measure-time-of-program-execution-and-store-that-inside-a-variable

On Fri, Sep 11, 2015 at 7:57 AM, Naba <nabajyoti.goswami at gmail.com> wrote:

> Is it possible to calculate total percentage of time invested to attain a
> minima from Gibbs free energy landscape obtained by g_sham output, such as
> from gibbs.xpm? Please guide me if there is any script available to do it.
>
> Nabajyoti Goswami
>
> Bioinformatics Infrastructure Facility
> Department of Animal Biotechnology
> College of Veterinary Science
> Khanapara,Guwahati 781022
> Assam, India
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-request at gromacs.org.
>


More information about the gromacs.org_gmx-users mailing list