[gmx-users] g_hbond

Justin A. Lemkul jalemkul at vt.edu
Mon Aug 23 14:49:05 CEST 2010



pawan raghav wrote:
> Below is the hbond.xvg content 1 coloumn is for time second for numbers, 
> but I am not getting for 3rd one i.e. Pairs within 0.35 nm is this shows 
> area in cutoff range?
>  

Search the mailing list archive.  I answered this identical question last week. 
    If you use the phrase "g_hbond third column" (without quotes) you'll find 
your answer.

-Justin

> @ title "Hydrogen Bonds"
> 
> @ xaxis label "Time"
> 
> @ yaxis label "Number"
> 
> @TYPE xy
> 
> @ view 0.15, 0.15, 0.75, 0.85
> 
> @ legend on
> 
> @ legend box on
> 
> @ legend loctype view
> 
> @ legend 0.78, 0.8
> 
> @ legend length 2
> 
> @ s0 legend "Hydrogen bonds"
> 
> @ s1 legend "Pairs within 0.35 nm"
> 
> 0 2 175
> 
> 3 2 188
> 
> 6 3 190
> 
> 9 4 190
> 
> 12 2 190
> 
> 15 3 182
> 
> 18 0 183
> 
> 21 3 179
> 
> 
> 
> -- 
> Pawan
> 

-- 
========================================

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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