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Re: [ESPResSo-devel] Nsquare cellsystem and folded positions

From: Axel Arnold
Subject: Re: [ESPResSo-devel] Nsquare cellsystem and folded positions
Date: Mon, 13 Aug 2007 17:42:17 +0200
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On Monday 13 August 2007 17:31, Kai Grass wrote:
> > PS: Is there any deeper reason why the constraints only work with
> > the LJ
> > ia, and not with other ias as well?
> They are not implemented as general interactions but just as LJ
> potential.

Well, that is true at the moment, but actually, the call interface for lj and 
for the add_nonbonded_pairforce are quite similar. So, one can just replace 
things. We (aka Olaf :-) ) could do it together with introducing the folding.


Dr. Axel Arnold
FOM Institute for Atomic and Molecular Physics
Kruislaan 407                                   Phone: +31 20 6081 275
1098 SJ Amsterdam, The Netherlands              E-mail: address@hidden

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