[gmx-users] warning message while using eneconv

David van der Spoel spoel at xray.bmc.uu.se
Fri Dec 29 08:58:45 CET 2006

sunita at chem.iitb.ac.in wrote:
> Dear David,
> Thanks for your reply.
> pls suggest how to get rid of these warning messages.
> I do not find where is the mistake.
> Thank you very much.
> sunita

could it be that you have done more than two billion time steps? in that 
case the step counter overflows and becomes negative.

David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
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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