[gmx-users] .itp file for cyclohexane (gromos96 FF)

Justin A. Lemkul jalemkul at vt.edu
Thu Nov 20 04:11:18 CET 2008

Isabella Daidone wrote:
> Hi everybody,
> I was wondering if anybody has, and is willing to send me, a .itp file 
> for cyclohexane with gromos96 parameters.
> I searched the list, but could not find any.
> I apologize if I've missed it in the list.

Since Gromos96 is a united-atom force field, to create one with a text editor 
would be very simple, with the aid of Chapter 5 of the manual.


> Thank you very much,
> Isabella
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Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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