Re: [AMBER] IMPROPER TERM CONTRIBUTION

From: case <case.biomaps.rutgers.edu>
Date: Wed, 17 Mar 2010 07:49:19 -0400

On Wed, Mar 17, 2010, Peter Charles Kahuna wrote:
>
> http://ambermd.org/
>
> I would like to know how the improper contributions are included?
>
> i.e. what is the form of the function?. Is it simmilar for example to
> the CHARMM forcefield?

Improper terms in Amber have the same functional forms as "proper" dihedrals.
This is different from CHARMM.

...good luck....dac


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Received on Wed Mar 17 2010 - 05:00:04 PDT
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