Re: amber-developers: evb based mixing

From: David A. Case <>
Date: Tue, 18 Oct 2005 15:14:43 -0700

On Tue, Oct 18, 2005, Ilyas Yildirim wrote:
> Sorry for the late reply. I was busy with moving to a new apartment, so
> could not check out my emails regularly. The purpose of this
> was to use the dummy atoms in the initial state, too. According to AMBER
> 8, we can have dummy atoms at the final state. We (me and Dr. Harry
> from U of R, Dept. of Chemistry) tried to mimic the smooth transition of
> the original mixing function, (1-lambda)^klambda, around lambda=0,

Thanks for the the info. I've put this into amber9/doc/ You
check to see if it looks OK.

Received on Wed Apr 05 2006 - 23:49:52 PDT
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