[gmx-users] How to do rdf with out normalization?

Justin A. Lemkul jalemkul at vt.edu
Tue Aug 24 23:39:16 CEST 2010



Xiaoling Leng wrote:
> Hi all, I want to compute the Radial distribution function with out
> normalization, using g_rdf.
> Or in another word, I want use g_rdf to count the numbers of the times
> that 2 groups in certain distances. How could I do that? Could I use

You might extract some useful information with g_dist -dist.

> some method to change the option -norm in g_rdf which in default is
> "yes" to "no"?
> 

The switch would be -nonorm.

-Justin

> Thanks in advance.
> 
> Xiaoling Leng

-- 
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Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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