[gmx-users] NPT simulation problem

nicolas Dinter dinter at rc.m-kagaku.co.jp
Thu May 20 02:51:38 CEST 2004


Hi Gromacs users,

So I found a solution to my NPT simulation problem: First of all my box was
realy too tall, actualy I needed a 3*3*3 box (inteed of 30*30*30), then I
generated the input files via the Dundee PRODRG2 Server web site, so I get
the good force field parameters and now my simulation runs well.
Thank you to all Gromacs users for their help.
Nicolas.




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