Re: Parameter File Problem

From: Brian Bennion (brian_at_youkai.llnl.gov)
Date: Mon May 10 2004 - 23:59:53 CDT

Hi Nicholas,

This has been discussed on the list before, in this case the psf file has
too many dihedral angles for the same interaction. Most likely caused by
to many atoms in a new residue in the top_all2X.inp file.

Brian

 On Mon, 10 May 2004 beckloni_at_umdnj.edu
wrote:

> What does this message mean?
>
> "Multiplicity of Paramters for diehedral bond CT2 HA CT2 HA of 1 exceeded"
>
> Sincerely,
> Nicholas
>
> --
>

*****************************************************************
**Brian Bennion, Ph.D. **
**Computational and Systems Biology Division **
**Biology and Biotechnology Research Program **
**Lawrence Livermore National Laboratory **
**P.O. Box 808, L-448 bennion1_at_llnl.gov **
**7000 East Avenue phone: (925) 422-5722 **
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