Re: AMBER: Error while running resp.

From: David A. Case <case.scripps.edu>
Date: Tue, 25 Jan 2005 08:43:32 -0800

On Tue, Jan 25, 2005, praveena moldy wrote:
>
>
> I was trying to create the resp input file for a small system C20 from the
> gaussian file with the help of antechamber.
>
> antechamber -i c20.out -fi gout -o c20.mol2 -fo mol2 -c resp
>
> Some errors like :
>
> The ring number exceeds MAXRING, increase MAXRING and recompile the
> programs, exit.

We would need to see your small input to know more. Note that the system must
be an ordinary, closed-shell organic molecule will all hydrogens present.
(Not sure what your label "C20" means....).

....dac

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Received on Tue Jan 25 2005 - 16:53:00 PST
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