mailr21419 - /trunk/test_suite/system_tests/scripts/n_state_model/pyrotartaric_anhydride.py


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Posted by edward on November 13, 2013 - 14:26:
Author: bugman
Date: Wed Nov 13 14:26:23 2013
New Revision: 21419

URL: http://svn.gna.org/viewcvs/relax?rev=21419&view=rev
Log:
Fix for the pyrotartaric_anhydride.py N-state model system test script.

This is used in two system tests.  The user function call for reading the 
inter-spin distances was
instead reading the J couplings as the distance.


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

Modified: 
trunk/test_suite/system_tests/scripts/n_state_model/pyrotartaric_anhydride.py
URL: 
http://svn.gna.org/viewcvs/relax/trunk/test_suite/system_tests/scripts/n_state_model/pyrotartaric_anhydride.py?rev=21419&r1=21418&r2=21419&view=diff
==============================================================================
--- 
trunk/test_suite/system_tests/scripts/n_state_model/pyrotartaric_anhydride.py 
(original)
+++ 
trunk/test_suite/system_tests/scripts/n_state_model/pyrotartaric_anhydride.py 
Wed Nov 13 14:26:23 2013
@@ -39,7 +39,7 @@
 self._execute_uf(uf_name='spin.isotope', isotope='1H', spin_id='@Q*')
 
 # Define the magnetic dipole-dipole relaxation interaction.
-self._execute_uf(uf_name='interatom.read_dist', file='R_rdcs', 
dir=data_path, unit='Angstrom', spin_id1_col=1, spin_id2_col=2, data_col=5)
+self._execute_uf(uf_name='interatom.read_dist', file='R_rdcs', 
dir=data_path, unit='Angstrom', spin_id1_col=1, spin_id2_col=2, data_col=7)
 self._execute_uf(uf_name='interatom.unit_vectors', ave=False)
 
 # Load the J and J+D data.




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