[gmx-users] Fwd: Rycaert-Bellemans function

Justin Lemkul jalemkul at vt.edu
Tue May 14 00:29:21 CEST 2013

On 5/13/13 6:24 PM, Marcelo Vanean wrote:
> Hello to all. I am simulating long-chain alcohols. For the dihedrals, I
> used Rycaert-Bellemans function. In this case I should delete the pairs
> from topology?

That depends on which force field you are using.  See manual section 4.2.12.



Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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