mailr7146 - /branches/rdc_analysis/specific_fns/n_state_model.py


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Posted by edward on August 11, 2008 - 18:12:
Author: bugman
Date: Mon Aug 11 15:28:34 2008
New Revision: 7146

URL: http://svn.gna.org/viewcvs/relax?rev=7146&view=rev
Log:
Fixed the atom_loop() call in __minimise_setup_pcs().


Modified:
    branches/rdc_analysis/specific_fns/n_state_model.py

Modified: branches/rdc_analysis/specific_fns/n_state_model.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/rdc_analysis/specific_fns/n_state_model.py?rev=7146&r1=7145&r2=7146&view=diff
==============================================================================
--- branches/rdc_analysis/specific_fns/n_state_model.py (original)
+++ branches/rdc_analysis/specific_fns/n_state_model.py Mon Aug 11 15:28:34 
2008
@@ -394,7 +394,7 @@
             for c in range(cdp.N):
                 # Get the paramagnetic coordinates.
                 i = 0
-                for R in cdp.structure.atom_loop(atom_id=cdp.para_id, 
pos_flag=True):
+                for R in 
cdp.structure.atom_loop(atom_id=cdp.paramagnetic_centre, str_id=c, 
pos_flag=True):
                     i = i + 1
 
                 # Can only be one paramagnetic centre (for now).




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