mailr22997 - /trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.py


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Posted by edward on May 06, 2014 - 16:32:
Author: bugman
Date: Tue May  6 16:32:51 2014
New Revision: 22997

URL: http://svn.gna.org/viewcvs/relax?rev=22997&view=rev
Log:
Updated the rotor2 CaM frame order test data optimisation script for the 
changed notation.

A new set of notations is now being used to try to solve a nasty alpha angle 
parameterisation bug.

Modified:
    trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.py

Modified: trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.py
URL: 
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.py?rev=22997&r1=22996&r2=22997&view=diff
==============================================================================
--- trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.py  
(original)
+++ trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.py  Tue 
May  6 16:32:51 2014
@@ -18,18 +18,17 @@
     axis = zeros(3, float64)
     spherical_to_cartesian([1, theta, phi], axis)
 
-    # The pivot-CoM axis.
-    piv_com = com - pivot
-    piv_com /= norm(piv_com)
+    # The CoM-pivot axis.
+    com_piv = com - pivot
+    com_piv /= norm(com_piv)
 
     # The mu_xy vector.
     z_axis = array([0, 0, 1], float64)
-    mu_xy = cross(piv_com, z_axis)
+    mu_xy = cross(z_axis, com_piv)
     mu_xy /= norm(mu_xy)
 
     # The alpha angle.
-    return vector_angle(mu_xy, axis, piv_com)
-    #return vector_angle(axis, mu_xy, piv_com)
+    return vector_angle(mu_xy, axis, com_piv)
 
 
 def shift_pivot(pivot_orig=None, com=None, theta=None, phi=None):




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