[gmx-users] running grompp

[David van der Spoel]

On Wed, 22 May 2002, Valentin Gogonea wrote:

>I am trying to get grompp running for the following files. I constructed 
>the topology by hand. I get  an error message. It says:
>
>  Fatal error: number of coordinates in coordinate file 
>(MeCO_Met_NHMe.pdb, 16)
>              does not match topology (MeCO_Met_NHMe.top, 0)

Your topology does not define a [ system ] section. See manual.


-- 
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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