r8559 - /branches/multi_structure/generic_fns/structure/api_base.py -- January 21, 2009 - 18:11

Author: bugman
Date: Wed Jan 21 18:11:38 2009
New Revision: 8559

URL: http://svn.gna.org/viewcvs/relax?rev=8559&view=rev
Log:
Fixes for the molecule name variable in pack_structs().


Modified:
    branches/multi_structure/generic_fns/structure/api_base.py

Modified: branches/multi_structure/generic_fns/structure/api_base.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/multi_structure/generic_fns/structure/api_base.py?rev=8559&r1=8558&r2=8559&view=diff
==============================================================================
--- branches/multi_structure/generic_fns/structure/api_base.py (original)
+++ branches/multi_structure/generic_fns/structure/api_base.py Wed Jan 21 
18:11:38 2009
@@ -366,8 +366,8 @@
 
             # Loop over the structures.
             for j in range(len(self.structural_data[i].mol)):
-                if self.structural_data[i].num in set_model_num and 
self.structural_data[i].mol[j].name in set_mol_name:
-                    raise RelaxError, "The molecule '%s' of model %s already 
exists." % (self.structural_data[i].mol[j].name, self.structural_data[i].num)
+                if self.structural_data[i].num in set_model_num and 
self.structural_data[i].mol[j].mol_name in set_mol_name:
+                    raise RelaxError, "The molecule '%s' of model %s already 
exists." % (self.structural_data[i].mol[j].mol_name, 
self.structural_data[i].num)
 
         # Loop over the models.
         for i in range(len(set_model_num)):