[gmx-users] increase the number of atoms in tip5p

David spoel at xray.bmc.uu.se
Tue May 31 21:55:38 CEST 2005


On Tue, 2005-05-31 at 16:27 -0300, Lin Zhen wrote:
> Dear all,
> 
>    I am trying to increase the tip5p system size, so do i have to run
> "pdb2gmx" to creat a new tip5p.gro file?
No, try genbox or genconf.
> 
> Thanks davidfor your help, gromacs runs very well now.
> 
-- 
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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