[gmx-users] FENE potential-bond interaction

Tsjerk Wassenaar tsjerkw at gmail.com
Mon Dec 11 10:29:32 CET 2006


More than possible, it has already been done. Manual chapter 4.2.4,
page 51. And please give me a very good reason why I now picked up the
manual and looked for FENE, instead of you.


On 12/11/06, Mark Abraham <Mark.Abraham at anu.edu.au> wrote:
> Argyrios Karatrantos wrote:
> > HI,
> > is it possible to implement the FENE potential for the bond interaction.
> > i know that you can user harmonic, and morse potential for bonds, but
> > the FENE has been used extensively for coarse grained simulations.
> It's possible.
> Posting a reference or a link to a description might get you some real help.
> Mark
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Tsjerk A. Wassenaar, Ph.D.
Junior UD (post-doc)
Biomolecular NMR, Bijvoet Center
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
P: +31-30-2539931
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