[gmx-users] g_rdf

David van der Spoel spoel at xray.bmc.uu.se
Wed Mar 7 16:09:11 CET 2007


marco cammarata wrote:
> Hi,
> 
> I'm using g_rdf to calculate the RDF of a system.
> The "r range" ends at 3nm.
> I would like to change it to 100nm but it seems that there are
> no option for it.
> Can you help me ?
> thanks,
> marco
> 
The CVS version has an option to turn off the periodic boundary 
conditions. That only makes sense in special cases though.

-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se
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