[gmx-users] gold-S simulation
francesco.oteri at gmail.com
Sun Dec 16 19:11:14 CET 2012
thank you for the references. Regarding your problem, what does it means
you don't see any interaction?
Is it possible it is just a problem of the visualization software. To be
sure, you could monitor the distance
between any S atom and the Au atom to which it is supposed to be bound. If
the distance is stable around
the equilibrium value you can say that the interaction is still present
2012/12/16 fatemeh ramezani <fr_750 at yahoo.com>
> thanks for your attention,
> all itp files are in OPLSAA forcefield folder that I attached it for you.
> Fatemeh Ramezani
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Cordiali saluti, Dr.Oteri Francesco
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