[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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