Re: [AMBER] error in save prmtop

From: Bill Ross <ross.cgl.ucsf.edu>
Date: Tue, 23 Mar 2010 10:37:37 -0700 (PDT)

> (Residues lacking connect0/connect1 -
> these don't have chain types marked:
> res total affected
> CGLN 1
> NMET 1
> WAT 7657

This is not a problem. Chain types were useful with an old analysis
program (used for getting backbone torsions).

Probably it would be better to strip this functionality from leap now.

Bill

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Received on Tue Mar 23 2010 - 11:00:03 PDT
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