mailr17132 - /branches/interatomic/generic_fns/mol_res_spin.py


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Posted by edward on July 02, 2012 - 17:52:
Author: bugman
Date: Mon Jul  2 17:52:48 2012
New Revision: 17132

URL: http://svn.gna.org/viewcvs/relax?rev=17132&view=rev
Log:
The generic_fns.mol_res_spin.index_molecule() function now handles no 
molecule name given.

If no name is given and only a single molecule is in the current data pipe, 
then the index of 0 will
be returned.


Modified:
    branches/interatomic/generic_fns/mol_res_spin.py

Modified: branches/interatomic/generic_fns/mol_res_spin.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/interatomic/generic_fns/mol_res_spin.py?rev=17132&r1=17131&r2=17132&view=diff
==============================================================================
--- branches/interatomic/generic_fns/mol_res_spin.py (original)
+++ branches/interatomic/generic_fns/mol_res_spin.py Mon Jul  2 17:52:48 2012
@@ -1809,10 +1809,14 @@
     """Return the index of the molecule of the given name.
 
     @keyword mol_name:  The name of the molecule.
-    @type mol_name:     str
+    @type mol_name:     str or None
     @return:            The index of the molecule, if it exists.
     @rtype:             int or None
     """
+
+    # Single molecule and no name given.
+    if mol_name == None and len(cdp.mol) == 1:
+        return 0
 
     # Loop over the molecules.
     i = 0




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