[gmx-users] RE: mdp files
vvchaban at gmail.com
Mon Jun 23 18:47:07 CEST 2008
> Thanks for the tutorial. I was going through the steps and ran into a
> problem when placing in the ions in order to neutralize the system. Would
> this because my version of Gromacs is 3.1 and your tutorial is for v3.3.3?
I suppose you can add these ions even by hand. It shouldn't be a very
big quantity of them.
Vitaly V. Chaban
School of Chemistry
National University of Kharkiv
Svobody sq.,4, Kharkiv 61077, Ukraine
email: chaban at univer.kharkov.ua
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