[gmx-users] How to assign/make ionion bonds ?

Justin A. Lemkul jalemkul at vt.edu
Fri Oct 24 19:48:56 CEST 2008



Chih-Ying Lin wrote:
> Hi
> How to assign / make ionion bonds?
> 

Assign them yourself in the [ bonds ] section of the topology.  As for what 
parameters to assign to such a species, that's up to you; they probably don't 
exist in the standard force fields within Gromacs...

-Justin

> Thank you
> Lin
> 
> 
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-- 
========================================

Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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