[gmx-users] spc water questions

David van der Spoel spoel at xray.bmc.uu.se
Thu Jul 8 11:04:43 CEST 2004


On Thu, 2004-07-08 at 10:48, コウ チ wrote:
> hi.
> i want to use spc water model to do some MD simulations. but in the 
> database of gromacs there is only spc216.gro. i want to creat a new 
> spc*.gro file which the numbers of water is much larger than spc216.gro. 
> how can i do it?
>                        
genconf or genbox
>                                                      
>      caoch 
>                                                                             
>       tokyo institute technology
> 
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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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