[gmx-users] g_cluster

David van der Spoel spoel at xray.bmc.uu.se
Wed Sep 25 17:10:09 CEST 2002


On Wed, 2002-09-25 at 15:52, Sebastien Santini wrote:
> Hi,
> 
> g_cluster generate a file called rmsd-dist.xvg with the option  -dist.
> I don't understand the meaning of "a.u." on the y-axis of this file.
> I just want a file with RMS deviation on the x-axis and #structures on 
> the y-axis.
It probably means arbitrary units. I think it should do what you want,
if you think it is incorrect, please check the source code...


-- 
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://zorn.bmc.uu.se/~spoel
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