Re: [AMBER] atomic radii of ions

From: case <>
Date: Sun, 25 Jul 2010 16:28:06 -0400

On Sun, Jul 25, 2010, Paul S. Nerenberg wrote:
> I must confess that I'm not exactly sure what the "parse" radii are,
> but I think they are related to PB calculations done by Barry Honig's
> group ~15 years ago. Hopefully someone else on the list can provide
> additional background info on these radii...

See this reference:

%A D. Sitkoff
%A K.A. Sharp
%A B. Honig
%T Accurate calculation of hydration free energies using macroscopic solvent
%J J. Phys. Chem.
%V 98
%P 1978-1988
%D 1994


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Received on Sun Jul 25 2010 - 13:30:03 PDT
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