Re: [AMBER] angle force constants in GAFF

From: case <case.biomaps.rutgers.edu>
Date: Thu, 8 Apr 2010 08:27:43 -0400

On Thu, Apr 08, 2010, João Sardinha wrote:
>
> I'm trying to reproduce the angle force constants in GAFF as described
> in J. Comput. Chem. 25: 1157-1174, (2004), in particular,

Did you take account of the erratum: JCC 26:114 (2005)?

...dac


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Received on Thu Apr 08 2010 - 05:30:04 PDT