Re: [AMBER] atom-type cz ???

From: Jason Swails <jason.swails.gmail.com>
Date: Thu, 8 Jul 2010 16:13:32 -0400

Shouldn't cz also be in gaff? Especially since gaff refers to cz in several
parts...

On Thu, Jul 8, 2010 at 4:06 PM, David A. Case <case.biomaps.rutgers.edu>wrote:

> On Thu, Jul 08, 2010, M. Shahid wrote:
> >
> >
> > No mass defined for non-bond atom type: cz - skipping
> >
> > while the frcmod file contains this atom type:
> >
> > ================================================
> > remark goes here
> > MASS
> >
> > BOND
>
> Add a "cz" entry to the MASS section of your frcmod file; that is the
> meaning
> of the phrase "no mass defined for ... atom type cz".
>
> ...good luck...dac
>
>
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-- 
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Graduate Student
352-392-4032
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Received on Thu Jul 08 2010 - 13:30:04 PDT
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