r26347 - /trunk/test_suite/system_tests/scripts/n_state_model/CaM_IQ_tensor_fit.py -- October 22, 2014 - 14:37

Author: bugman
Date: Wed Oct 22 14:37:25 2014
New Revision: 26347

URL: http://svn.gna.org/viewcvs/relax?rev=26347&view=rev
Log:
Modified the N_state_model.test_CaM_IQ_tensor_fit system/GUI test for 
implementing a new feature.

The 'spin_selection' argument has been added to the interatom.define user 
function.  This will be
used to carry the spin selections over into the interatomic data containers.


Modified:
    trunk/test_suite/system_tests/scripts/n_state_model/CaM_IQ_tensor_fit.py

Modified: 
trunk/test_suite/system_tests/scripts/n_state_model/CaM_IQ_tensor_fit.py
URL: 
http://svn.gna.org/viewcvs/relax/trunk/test_suite/system_tests/scripts/n_state_model/CaM_IQ_tensor_fit.py?rev=26347&r1=26346&r2=26347&view=diff
==============================================================================
--- trunk/test_suite/system_tests/scripts/n_state_model/CaM_IQ_tensor_fit.py  
  (original)
+++ trunk/test_suite/system_tests/scripts/n_state_model/CaM_IQ_tensor_fit.py  
  Wed Oct 22 14:37:25 2014
@@ -28,7 +28,7 @@
 self._execute_uf(uf_name='select.display')
 
 # Define the magnetic dipole-dipole relaxation interaction.
-self._execute_uf(uf_name='interatom.define', spin_id1='@N', spin_id2='@H', 
direct_bond=True)
+self._execute_uf(uf_name='interatom.define', spin_id1='@N', spin_id2='@H', 
spin_selection=True, direct_bond=True)
 self._execute_uf(uf_name='interatom.set_dist', spin_id1='@N', spin_id2='@H', 
ave_dist=NH_BOND_LENGTH_RDC)
 self._execute_uf(uf_name='interatom.unit_vectors', ave=False)