Re: [AMBER] force field parameter and resp charge calculation

From: FyD <>
Date: Wed, 30 Jun 2010 16:58:33 +0200


> thanks for the clarification! However, back to my question, why the
> resp program in antechamber can't perform the fitting for my molecule?

Antechamber does RESP charge fitting; concerning multiple conformation
and/or multiple orientation, I am not sure... or you have to adapt
some steps manually.

regards, Francois

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Received on Wed Jun 30 2010 - 08:00:05 PDT
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