[gmx-users] initial_configuration_sw_water

David van der Spoel spoel at xray.bmc.uu.se
Thu Jul 31 13:56:00 CEST 2008

Sang-Min Park wrote:
> Hello everybody, 
> I read somewhere that one can get the sw.gro file, by adding the shell and 
> dummy particles (with the same coordinates as the oxygen) into the spc216.gro 
> file. 
> Is this right ? and when not how can I get the sw.gro file ? 
rename the tip5p.gro file.
> thank you for your time
> Sang Min 
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David van der Spoel, Ph.D., Professor of Biology
Molec. Biophys. group, Dept. of Cell & Molec. Biol., Uppsala University.
Box 596, 75124 Uppsala, Sweden. Phone:	+46184714205. Fax: +4618511755.
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se

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