r18250 - /trunk/specific_fns/n_state_model.py -- January 21, 2013 - 21:33

Author: bugman
Date: Mon Jan 21 21:33:40 2013
New Revision: 18250

URL: http://svn.gna.org/viewcvs/relax?rev=18250&view=rev
Log:
Fix for the N-state model _minimise_setup_atomic_pos() method for the 
paramagnetic centre.

The cdp.paramagnetic_centre_sim may not exist prior to Monte Carlo 
simulations.


Modified:
    trunk/specific_fns/n_state_model.py

Modified: trunk/specific_fns/n_state_model.py
URL: 
http://svn.gna.org/viewcvs/relax/trunk/specific_fns/n_state_model.py?rev=18250&r1=18249&r2=18250&view=diff
==============================================================================
--- trunk/specific_fns/n_state_model.py (original)
+++ trunk/specific_fns/n_state_model.py Mon Jan 21 21:33:40 2013
@@ -899,7 +899,7 @@
         if not hasattr(cdp, 'paramagnetic_centre'):
             paramag_centre = zeros(3, float64)
         elif sim_index != None:
-            if cdp.paramagnetic_centre_sim[sim_index] == None:
+            if not hasattr(cdp, 'paramagnetic_centre_sim') or 
cdp.paramagnetic_centre_sim[sim_index] == None:
                 paramag_centre = zeros(3, float64)
             else:
                 paramag_centre = 
array(cdp.paramagnetic_centre_sim[sim_index])