r16979 - /branches/interatomic/data/mol_res_spin.py -- June 19, 2012 - 20:50

Author: bugman
Date: Tue Jun 19 20:50:23 2012
New Revision: 16979

URL: http://svn.gna.org/viewcvs/relax?rev=16979&view=rev
Log:
Fix for the backward compatibility hook for MoleculeContainers - the H spin 
containers are deselected.


Modified:
    branches/interatomic/data/mol_res_spin.py

Modified: branches/interatomic/data/mol_res_spin.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/interatomic/data/mol_res_spin.py?rev=16979&r1=16978&r2=16979&view=diff
==============================================================================
--- branches/interatomic/data/mol_res_spin.py (original)
+++ branches/interatomic/data/mol_res_spin.py Tue Jun 19 20:50:23 2012
@@ -644,6 +644,7 @@
 
                     # Create a new spin container for the proton, then set 
up a dipole interaction between the two spins.
                     h_spin = 
generic_fns.mol_res_spin.create_spin(mol_name=self.name, res_num=res.num, 
res_name=res.name, spin_name='H')
+                    h_spin.select = False
                     spin_id1 = 
generic_fns.mol_res_spin.generate_spin_id(mol_name=self.name, 
res_num=res.num, res_name=res.name, spin_name=spin.name, spin_num=spin.num)
                     spin_id2 = 
generic_fns.mol_res_spin.generate_spin_id(mol_name=self.name, 
res_num=res.num, res_name=res.name, spin_name='H')
                     generic_fns.dipole_pair.define(spin_id1, spin_id2, 
verbose=False)