[gmx-users] How the angle/bond length changes during simulation.
jalemkul at vt.edu
Wed Mar 9 16:12:10 CET 2016
On 3/9/16 10:11 AM, Dawid das wrote:
> 2016-03-09 16:07 GMT+01:00 Justin Lemkul <jalemkul at vt.edu>:
>> You are. That's what -all is for:
>> "Plot all angles separately in the averages file, in the order of
>> appearance in the index file."
>> Open up angaver.xvg and you will see the average, then the two individual
>> time series.
> Than something does not work for me, because what I get is:
> -180 0.027099
> -179 0.025099
> -178 0.023980
> -177 0.022160
> -176 0.019040
> -175 0.016480
> -174 0.016160
> and so on
That must be angdist.xvg because that is a distribution, not a time series.
Justin A. Lemkul, Ph.D.
Ruth L. Kirschstein NRSA Postdoctoral Fellow
Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 629
University of Maryland, Baltimore
20 Penn St.
Baltimore, MD 21201
jalemkul at outerbanks.umaryland.edu | (410) 706-7441
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