Re: [AMBER] boron nitride

From: David A Case <david.case.rutgers.edu>
Date: Tue, 1 Feb 2022 08:20:25 -0500

On Tue, Feb 01, 2022, Victor Nazarychev wrote:
>
>Is it possible to parametrize boron nitride particles in the GAFF force
>field?

Not at present. In preparation is an expansion of the elements covered by
GAFF, which will include boron. But that's not ready yet.

....dac


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Received on Tue Feb 01 2022 - 05:30:02 PST
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