[gmx-users] fixing HOH

Alan Wilter Sousa da Silva alan at lncc.br
Sun Oct 17 23:03:40 CEST 2004


Hi List!

I was wondering if pdb2gmx is able to rebuild missing Hidrogens of
structural waters from cristallographic PDB.

Maybe does it depends on PDB atom nomenclature?

Thanks for any help.
Cheers,
Alan

-- 
--------------------------
Alan Wilter Sousa da Silva
--------------------------
D.Sc. - IBCCF/UFRJ
Projeto BioPAUA - HP/LNCC
Petrópolis (RJ), Brasil
www.lncc.br/~alan



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