Re: [AMBER] Optimize in Gaussian with RESP

From: David A Case <david.case.rutgers.edu>
Date: Wed, 9 Mar 2016 07:43:49 -0500

On Wed, Mar 09, 2016, Jesmita Dhar wrote:

> Is it possible to get RESP charge from antechember?

Yes. Please see Section 15.4.6 of the Reference Manual. Many users find
it easier to use the R.E.D. server (linked from the Amber web page) to
generate RESP charges.

...good luck...dac


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Received on Wed Mar 09 2016 - 05:00:05 PST
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