[gmx-users] Justin tutorial - V-rescale + Parinello-Rahman

Steven Neumann s.neumann08 at gmail.com
Wed Apr 9 14:18:33 CEST 2014


Dear Gmx Users, Dear Justin

I have noticed that in in our tutorial(s) in thew mdp option you suggesting
V-rescale thermostat and the Parinello-Rahman barostat. Is there any
particular reason for this choice? Would you please provide any reference
that is combinantion works well in comparison to others or its just the
example?

Thanks for your response in advance,

Steven


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