mailr9013 - /branches/ave_noe/specific_fns/n_state_model.py


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Posted by edward on April 15, 2009 - 17:06:
Author: bugman
Date: Wed Apr 15 17:06:54 2009
New Revision: 9013

URL: http://svn.gna.org/viewcvs/relax?rev=9013&view=rev
Log:
Bug fix for the calc_ave_dist() method.

The negative of the exponential was being used!


Modified:
    branches/ave_noe/specific_fns/n_state_model.py

Modified: branches/ave_noe/specific_fns/n_state_model.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/ave_noe/specific_fns/n_state_model.py?rev=9013&r1=9012&r2=9013&view=diff
==============================================================================
--- branches/ave_noe/specific_fns/n_state_model.py (original)
+++ branches/ave_noe/specific_fns/n_state_model.py Wed Apr 15 17:06:54 2009
@@ -956,13 +956,13 @@
         for i in range(num_models):
             # Distance to the minus sixth power.
             dist = norm(spin1.pos[i] - spin2.pos[i])
-            ave_dist = ave_dist + dist**(-exp)
+            ave_dist = ave_dist + dist**(exp)
 
         # Average.
         ave_dist = ave_dist / num_models
 
         # The exponent.
-        ave_dist = ave_dist**(-1.0/exp)
+        ave_dist = ave_dist**(1.0/exp)
 
         # Return the average distance.
         return ave_dist




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