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Re: Array too small. Increase MPAIRS
- To: <modeller_usage@listsrv.ucsf.edu>
- Subject: Re: Array too small. Increase MPAIRS
- From: quentin kaas <kaas AT ligm.igh.cnrs.fr>
- Date: Tue, 18 Mar 2003 15:59:46 +0100
- Organization: CNRS - IGH
I resolved my MPAIRS problem in using the top_heav.lib topology library
instead of the top_allh.lib. As my model is quite big, the hydrogens may be
too numerous to be handled by Modeller.
Thank you for your help.
Quentin Kaas
Le Lundi 17 Mars 2003 16:08, Andrej Sali a écrit :
> Without seeing the input/output files, it probably indicates a difficult
> optimization problem that runs into many overlapping atom pairs. Can you
> improve the alignment?
>
> Andrej