[gmx-users] pdb2gmx error

David van der Spoel spoel at xray.bmc.uu.se
Fri Jul 14 21:37:05 CEST 2006


Viswanadham Sridhara wrote:
> Hi Gromacs Users,
> I am trying to use pdb2gmx with one of the .pdb files, and its says 
> fatal error : in .rtp at line:
> But it is not displaying any line number in rtp file to look at?
> any comments or advice to fix this problem or to know the source of the 
> problem?


run with -debug and check pdb2gmx.log file.
what kind of pdb file, which force field?

> Thanks in advance,
> -Vishy.
> 
> -- 
> Viswanadham Sridhara,
> Graduate Research Assistant,
> Old Dominion University,
> Norfolk, VA-23529.
> 
> 
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-- 
David.
________________________________________________________________________
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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