[gmx-users] ngmx crash
David van der Spoel
spoel at xray.bmc.uu.se
Thu May 8 08:20:54 CEST 2008
jayant james wrote:
> Hi!
> I am trying to get the intermediate structures from a 2ns simulation and
> I use ngmx for the same. I am able to open the visualizer using the command
> ngmx -f trj.trr -s pr.tpr
> But when I try to get the coordinate file (say 50ps) I get an error as
> given below. How am I to overcome this problem ? I am using the latest
> version og GMX!
What name did you type in?
Either
foo.pdb
or
bar.gro
should work (with extension that is).
> thanks
> Jayant
>
>
> -------------------------------------------------------
> Program ngmx, VERSION 3.3.3
> Source code file: confio.c, line: 1130
>
> Software inconsistency error:
> Not supported in write_sto_conf
> -------------------------------------------------------
>
>
>
>
> --
> Jayasundar Jayant James
>
> www.chick.com/reading/tracts/0096/0096_01.asp
> <http://www.chick.com/reading/tracts/0096/0096_01.asp>)
> Residence -24935864, cell-9841042164
>
>
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--
David van der Spoel, Ph.D.
Molec. Biophys. group, Dept. of Cell & Molec. Biol., Uppsala University.
Box 596, 75124 Uppsala, Sweden. Phone: +46184714205. Fax: +4618511755.
spoel at xray.bmc.uu.se spoel at gromacs.org http://folding.bmc.uu.se
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