[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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