mailr10204 - /1.3/maths_fns/frame_order.py


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Posted by edward on January 13, 2010 - 17:33:
Author: bugman
Date: Wed Jan 13 17:33:24 2010
New Revision: 10204

URL: http://svn.gna.org/viewcvs/relax?rev=10204&view=rev
Log:
Bug fix for the frame order isotropic cone target function.

The optimised rotation matrix for the alignment tensor orientations was being 
applied in reverse!!!


Modified:
    1.3/maths_fns/frame_order.py

Modified: 1.3/maths_fns/frame_order.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/maths_fns/frame_order.py?rev=10204&r1=10203&r2=10204&view=diff
==============================================================================
--- 1.3/maths_fns/frame_order.py (original)
+++ 1.3/maths_fns/frame_order.py Wed Jan 13 17:33:24 2010
@@ -256,11 +256,11 @@
 
             # Rotate the tensor (normal R.X.RT rotation).
             if self.full_in_ref_frame[i]:
-                self.tensor_3D = dot(self.rot, dot(self.tensor_3D, 
transpose(self.rot)))
+                self.tensor_3D = dot(transpose(self.rot), 
dot(self.tensor_3D, self.rot))
 
             # Rotate the tensor (inverse RT.X.R rotation).
             else:
-                self.tensor_3D = dot(transpose(self.rot), 
dot(self.tensor_3D, self.rot))
+                self.tensor_3D = dot(self.rot, dot(self.tensor_3D, 
transpose(self.rot)))
 
             # Convert the tensor back to 5D, rank-1 form.
             to_5D(self.red_tensors_bc[index1:index2], self.tensor_3D)




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