nevermind its just the cosine On Wed, May 4, 2011 at 3:36 PM, jeremy adler <jeremyead...@gmail.com> wrote:
> Hi, > > When i used g_sgangle, i specified 2 index groups of 3 atoms each and gave > the -oa flag to get the angle between them. I got two columns of output > (besides the time index) - one with much larger values on the right (they > look reasonable) and one with much smaller values on the left. what is the > difference between these two outputs? > # This file was created Wed May 4 15:25:23 2011 > # by the following command: > # g_sgangle -f ../../exp.1/fullsystem.md.restart.1.xtc -s > ../../exp.1/fullsystem.md.restart.1.tpr -n helixorient.ndx -oa > exp1.cross.xvg > # > # g_sgangle is part of G R O M A C S: > # > # Gnomes, ROck Monsters And Chili Sauce > # > @ title "Angle between aproa and aprob" > @ xaxis label "Time (ps)" > @ yaxis label "Angle (degrees)" > @TYPE xy > 0 0.803241 36.5593 > 150 0.995972 5.14453 > 300 0.909836 24.5173 > > > thanks > > Jeremy >
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