Re: AMBER: Induced dipole in AMBER8

From: David A. Case <case.scripps.edu>
Date: Fri, 22 Apr 2005 18:23:41 -0700

On Fri, Apr 22, 2005, Cenk Andac wrote:
>
> Could someone please formulate inddip used in sander?

This is probably the best reference:

%A A. Toukmaji
%A C. Sagui
%A J. Board
%A T. Darden
%T Efficient particle-mesh Ewald based approach to fixed and induced
dipolar interactions
%J J. Chem. Phys.
%V 113
%P 10913-10927
%D 2000

.....dac

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Received on Sat Apr 23 2005 - 02:53:00 PDT
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