AMBER Archive (2008)

Subject: Re: AMBER: dihedral energy in amber

From: David A. Case (case_at_scripps.edu)
Date: Sat Feb 23 2008 - 10:37:09 CST

On Sat, Feb 23, 2008, aneesh cna wrote:

> I am using Amber 9 for my simulation. I am interested in knowing about
> the dihedral energy calculation performed by Amber. In this regard I tried
> to find the corresponding source code, but I couldn't . Can anyone tel me
> the exact source file name or the exact equation Amber using for calculating
> Dihedral energy.

Look in the ephi() routine in $AMBERHOME/src/sander/ene.f.

...dac

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