r11329 - /1.3/specific_fns/frame_order.py -- July 21, 2010 - 13:43

Author: bugman
Date: Wed Jul 21 13:43:49 2010
New Revision: 11329

URL: http://svn.gna.org/viewcvs/relax?rev=11329&view=rev
Log:
Fix for the frame order grid_search() method - the pseudo-elliptic parameters 
were incorrectly named.


Modified:
    1.3/specific_fns/frame_order.py

Modified: 1.3/specific_fns/frame_order.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/specific_fns/frame_order.py?rev=11329&r1=11328&r2=11329&view=diff
==============================================================================
--- 1.3/specific_fns/frame_order.py (original)
+++ 1.3/specific_fns/frame_order.py Wed Jul 21 13:43:49 2010
@@ -898,14 +898,14 @@
             # The pseudo-elliptic cone model parameters.
             if cdp.model == 'pseudo-ellipse':
                 # Cone opening angles.
-                if cdp.params[i] in ['theta_x', 'theta_y']:
-                    lower = 0.0
-                    upper = pi
+                if cdp.params[i] in ['cone_theta_x', 'cone_theta_y']:
+                    lower = pi * (1.0/incs[i])
+                    upper = pi * (1.0 - 1.0/incs[i])
 
                 # Torsion angle restriction.
-                if cdp.params[i] == 'sigma_max':
-                    lower = 0.0
-                    upper = pi
+                if cdp.params[i] == 'cone_sigma_max':
+                    lower = pi * (1.0/incs[i])
+                    upper = pi * (1.0 - 1.0/incs[i])
 
             # Over-ride the bounds.
             if lower_list: