[gmx-users] xtc error

David van der Spoel spoel at xray.bmc.uu.se
Sat Jan 30 20:39:23 CET 2010


On 1/30/10 8:29 PM, neo lotus wrote:
> Hi ,I am running to program, suddenly  in the 2000000 steps .program
> Pull In .( in .mdp file dt   was 0.002  and   nsteps  was  4000000)
> and  I see  following error : { xtc error –maybe you are out of quota
> }.please guide me .thanks.
Sounds like your file hit the 2Gb border, or you have extreme coordinates.

-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Professor of Biology
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se
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