JMandumpal wrote:
>
>
> >Dear all,
>
> >While running a job, since there was space problem I could not write
> the xtc files. Now when I do the analysis and use the trr file it
> reports the >time values after every 5ps i.e. 2000, 2005, 2010 etc.
> However I wish to >write the xtc file using trjc
--=20
Florian Dommert
Dipl.-Phys.
Computational and Theoretical Softmatter & Biophysics group
Frankfurt Institute for Advanced Studies
Johann-Wolfgang-Goethe University
Ruth-Moufang-Str. 1
60438 Frankfurt am Main
Phone: +49(0)69 / 798 - 47522
Fax: +49(0)69 / 798 - 47611
EMail: [EMAIL PROTECT
JMandumpal wrote:
>
>
> >Dear all,
>
> >While running a job, since there was space problem I could not write
> the xtc files. Now when I do the analysis and use the trr file it
> reports the >time values after every 5ps i.e. 2000, 2005, 2010 etc.
> However I wish to >write the xtc file using trjc
>Dear all,
>While running a job, since there was space problem I could not write the xtc
>files. Now when I do the analysis and use the trr file it reports the >time
>values after every 5ps i.e. 2000, 2005, 2010 etc. However I wish to >write the
>xtc file using trjconv such that the timestep
4 matches
Mail list logo