mailr12486 - /branches/bmrb/specific_fns/model_free/bmrb.py


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Posted by edward on February 01, 2011 - 16:41:
Author: bugman
Date: Tue Feb  1 16:41:04 2011
New Revision: 12486

URL: http://svn.gna.org/viewcvs/relax?rev=12486&view=rev
Log:
Better handling of the EntityID tag in the model-free saveframe.


Modified:
    branches/bmrb/specific_fns/model_free/bmrb.py

Modified: branches/bmrb/specific_fns/model_free/bmrb.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/bmrb/specific_fns/model_free/bmrb.py?rev=12486&r1=12485&r2=12486&view=diff
==============================================================================
--- branches/bmrb/specific_fns/model_free/bmrb.py (original)
+++ branches/bmrb/specific_fns/model_free/bmrb.py Tue Feb  1 16:41:04 2011
@@ -135,12 +135,12 @@
                 continue
 
             # The molecule index and name.
-            if 'entity_ids' in keys:
-                mol_index = []
-                for i in range(N):
+            mol_index = []
+            for i in range(N):
+                if 'entity_ids' in keys and data['entity_ids'] != None and 
data['entity_ids'][i] != None:
                     mol_index.append(int(data['entity_ids'][i]) -1 )
-            else:
-                mol_index = [0]*N
+                else:
+                    mol_index = [0]*N
             mol_names = []
             for i in range(N):
                 mol_names.append(cdp.mol[mol_index[i]].name)




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