[gmx-developers] MCDHO & Gromacs

[David van der Spoel]

On Mon, 2004-03-15 at 10:10, Rafael R. Pappalardo wrote:
> Dear Sir,
> I would like to know if the MCDHO water potential mentioned in the paper 
> J. Chem. Phys., 116(22) 9602-9610, 2002 (Hess, Saint-Martin 
> & Berendsen) is available in Gromacs.
Not in standard gromacs. A special tweaked version was used. Please
contact the authors of the paper...

> 
> Best regards,
-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assist. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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