[gmx-users] pdb2gmx problem

Daniela S. Mueller D.S.Mueller at rug.nl
Tue Mar 28 08:58:15 CEST 2006


hi, 

that's because your input-file was already in gro-format. use a pdb-file
and you will get the options. 

daniela


On Tue, 2006-03-28 at 11:30 +0800, Rongliang Wu wrote:
> Hello, gmx-users,
> 	when i added the appropriate terms to the .tdb file, i used "pdb2gmx -f .gro -ter" it didnot tell me to select the terminal groups, and the generated .top file has no connection between residues and the terminal groups are not changed. why?
> 
> Regards
> 
> Thanks
>  				
> 
>         Rongliang Wu
>         wurl04 at iccas.ac.cn
>           2006-03-28

-- 

Daniela S. Mueller

biologist (Diplom, German degree)
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