[gmx-users] "Specified frame doesn't exist or file not seekable" when using .xtc

Qiao Baofu qiaobf at gmail.com
Thu Nov 1 16:27:39 CET 2007


Hi,

I am using Gromacs 3.3.1.  The .xtc file is obtained from mdrun, as shown in
the following

; OUTPUT CONTROL OPTIONS
; Output frequency for coords (x), velocities (v) and forces (f)
nstxout                  = 0
nstvout                  = 0
nstfout                  = 0
; Checkpointing helps you continue after crashes
nstcheckpoint            = 0
; Output frequency for energies to log file and energy file
nstlog                   = 1000
nstenergy                = 100
; Output frequency and precision for xtc file
nstxtcout                = 10
xtc-precision            = 1000





2007/11/1, David van der Spoel <spoel at xray.bmc.uu.se>:
>
> Qiao Baofu wrote:
> > Hi, all
> >
> > When I using the .xtc file to analyse, I always meet the following error
> > information
> >   Specified frame doesn't exist or file not seekable
> > While it works when using the .trr file. In analyzing, only the
> > coordinate is used. Therefore, I want to use .xtc file. In this way, it
> > runs a little faster. However, the above proble exits.  What's wrong
> > with the .xtc file? and how to solve it?
> >
> gmx version please.
> > Thanks!
> >
> > --
> > Sincerely yours,
> > Dr. Baofu Qiao
> >
> >
> > ------------------------------------------------------------------------
> >
> > _______________________________________________
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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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>



-- 
Sincerely yours,
**********************************************
Dr. Baofu Qiao
Frankfurt Institute for Advanced Studies
Johann Wolfgang Goethe University
Ruth-Moufang Str. 1
60438 Frankfurt am Main, Germany
TEL:+49-69-79847522
**********************************************
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