[gmx-users] XTC error

David van der Spoel spoel at xray.bmc.uu.se
Thu May 23 20:42:40 CEST 2002


On Thu, 23 May 2002, Vincent Lemaitre wrote:

>Dear all, 
>
>While starting a MD, using mdrun (-np 1, single precision, Gromacs 3.1.3), I 
>get this error:
>
>"
>starting mdrun 'Protein'
>10000 steps,     20.0 ps.
>
>Fatal error: XTC error
Not many details in your report. It could be something physical, very 
large numbers, e.g. due to bad minimization

-- 
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Biomedical center, Dept. of Biochemistry
Husargatan 3, Box 576,  	75123 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://zorn.bmc.uu.se/~spoel
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