[gmx-users] Fatal error : pdb2gmx

David van der Spoel spoel at xray.bmc.uu.se
Fri Dec 30 08:43:13 CET 2005


poor nima wrote:
> Hai,
>  
> I am using version 3.2.1.  I am getting the following error when I run 
> pdb2gmx:
>  
> *Residue 50Fatal error: *Atom type IW (residue HO4) not found in 
> atomtype database
>  
> I have tried 4 different proteins. With all it gives the same error.
what force field?
>  
> can anybody help to solve this!
>  
> Happy New Year to all.
>  
> Thanks in advance.
>  
> With prayers,
> Poornima.
>  
>  
> 
> Send instant messages to your online friends http://in.messenger.yahoo.com
> 
> 
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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://xray.bmc.uu.se/~spoel
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