[gmx-users] g_angle

David spoel at xray.bmc.uu.se
Wed Oct 13 19:30:19 CEST 2004


On Wed, 2004-10-13 at 15:38, parinald at unsl.edu.ar wrote:
> Hi all:
>        I try to analize dihedral for my non-protein molècule using g_angle.
> The output file (option -od ) is:
> 
> 
> @    title "Dihedral Distribution: a_27_25_24_23"
> @    xaxis  label "Degrees"
> @    yaxis  label ""
> @TYPE xy
> @    subtitle "average angle: 6276.74\So\N"
>         70    0.000000
>         71    0.000444
>         72    0.000000
>        ....   ........
It's a histogram...
Angle distribution in arbitrary units.

> 
> The first column are degrees, and the second?.
>                                                Thank you
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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