mailr24859 - /branches/r1rho_plotting/specific_analyses/relax_disp/data.py


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Posted by tlinnet on July 30, 2014 - 22:27:
Author: tlinnet
Date: Wed Jul 30 22:27:20 2014
New Revision: 24859

URL: http://svn.gna.org/viewcvs/relax?rev=24859&view=rev
Log:
Fix for interpolation graph when plotting R1rho R2 as function of offset 
(ppm).

Missed to extract the offset value from list.

sr #3124(https://gna.org/support/?3124): Grace graphs production for R1rho 
analysis with R2_eff as function of Omega_eff.
sr #3138(https://gna.org/support/?3138): Interpolating theta through 
spin-lock offset [Omega], rather than spin-lock field strength [w1].

Modified:
    branches/r1rho_plotting/specific_analyses/relax_disp/data.py

Modified: branches/r1rho_plotting/specific_analyses/relax_disp/data.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/r1rho_plotting/specific_analyses/relax_disp/data.py?rev=24859&r1=24858&r2=24859&view=diff
==============================================================================
--- branches/r1rho_plotting/specific_analyses/relax_disp/data.py        
(original)
+++ branches/r1rho_plotting/specific_analyses/relax_disp/data.py        Wed 
Jul 30 22:27:20 2014
@@ -3167,6 +3167,7 @@
                     else:
                         theta = tilt_angles_inter[ei][si][mi][oi][di]
                         w_eff = w_eff_inter[ei][si][mi][oi][di]
+                        offset = 
frequency_to_ppm_from_rad(frq=offsets_inter[ei][si][mi][oi], B0=frq, 
isotope=current_spin.isotope)
 
                     # Return the x and y point.
                     x_point, y_point, err, y_err_point = 
return_grace_x_y_point(data_type=data_type, x_axis=x_axis, y_axis=y_axis, 
interpolate=interpolate, data_key=key, spin=current_spin, back_calc=r2eff, 
offset=offset, r1=r1[si][mi], r1_err=r1_err[si][mi], w_eff=w_eff, 
theta=theta, err=err)




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