mailr16980 - /branches/interatomic/specific_fns/model_free/results.py


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Posted by edward on June 19, 2012 - 20:51:
Author: bugman
Date: Tue Jun 19 20:51:22 2012
New Revision: 16980

URL: http://svn.gna.org/viewcvs/relax?rev=16980&view=rev
Log:
Fixes for the reading of relax 1.2 results files.

The new 'H' spin containers are now deselected, and the simulation structure 
creation has been
reverted.


Modified:
    branches/interatomic/specific_fns/model_free/results.py

Modified: branches/interatomic/specific_fns/model_free/results.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/interatomic/specific_fns/model_free/results.py?rev=16980&r1=16979&r2=16980&view=diff
==============================================================================
--- branches/interatomic/specific_fns/model_free/results.py (original)
+++ branches/interatomic/specific_fns/model_free/results.py Tue Jun 19 
20:51:22 2012
@@ -694,6 +694,7 @@
             # Create a new spin container for the proton, then set up a 
dipole interaction between the two spins.
             if data_set == 'value':
                 h_spin = create_spin(mol_name=mol_name, res_num=res_num, 
res_name=res_name, spin_name='H')
+                h_spin.select = False
                 spin_id2 = generate_spin_id(mol_name=mol_name, 
res_num=res_num, res_name=res_name, spin_name='H')
                 dipole_pair.define(spin_id, spin_id2, verbose=False)
 
@@ -730,7 +731,6 @@
 
                 # Selected simulations.
                 all_select_sim[-1].append(bool(file_line[col['select']]))
-                all_select_sim[-1].append(None)
 
                 # Initial printout for the simulation.
                 if verbosity:




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