[gmx-users] polarizable pair potentials
David van der Spoel
spoel at xray.bmc.uu.se
Tue Jan 10 12:53:13 CET 2006
Rongliang Wu wrote:
> Hello gmx-users,
> i wonder whether any polarizable pair potentials available in gromacs-3.3 or on the web?
> is the sw.gro polarizable water or polarized water?
>
POlarizable, check the Van Maaren 2001 paper (on my homepage).
>
> Thanks!
>
> Regards!
>
> Sincerely,
>
> Rongliang Wu
> State Key Laboratory
> of Polymer Physics and Chemistry
> Center of Molecular Science
> Institute of Chemistry
> Chinese Academy of Sciences
>
>
> wurl04 at iccas.ac.cn
> 2006-01-10
>
>
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>
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--
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. 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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