[gmx-users] bonds across boundaries

David van der Spoel spoel at xray.bmc.uu.se
Fri Oct 25 00:41:49 CEST 2002


On Fri, 2002-10-25 at 17:14, Pawel Sikorski wrote:
> Hi,
> Does anyone knows if it is possible to have chemical bonds across the
> boundaries in gmx - for example a infinitively  long polymer chain (the
> end is bonded to the image of the beginning). This is possible in some
> commercial software packages (Discover3, Cerius3) and in DL_poly.
this was discussed one or two days ago. check the archives. yes is the
answer.
> 
> Thanks for help.
> Pawel 
> 
> 
> 
> 
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-- 
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Biomedical center, Dept. of Biochemistry
Husargatan 3, Box 576,  	75123 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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