r12791 - /1.3/test_suite/system_tests/relax_data.py -- March 03, 2011 - 15:43

Author: bugman
Date: Thu Mar  3 15:43:09 2011
New Revision: 12791

URL: http://svn.gna.org/viewcvs/relax?rev=12791&view=rev
Log:
Created the test_back_calc_new() relaxation data system test for the back 
calculation of new data.


Modified:
    1.3/test_suite/system_tests/relax_data.py

Modified: 1.3/test_suite/system_tests/relax_data.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/test_suite/system_tests/relax_data.py?rev=12791&r1=12790&r2=12791&view=diff
==============================================================================
--- 1.3/test_suite/system_tests/relax_data.py (original)
+++ 1.3/test_suite/system_tests/relax_data.py Thu Mar  3 15:43:09 2011
@@ -84,3 +84,26 @@
 
             # Increment.
             index += 1
+
+
+    def test_back_calc_new(self):
+        """Test the back calculation of new relaxation data from model-free 
results."""
+
+        # Load the original state.
+        self.interpreter.state.load(state='sphere_trunc', 
dir=status.install_path + 
sep+'test_suite'+sep+'shared_data'+sep+'model_free'+sep+'bug_14941_local_tm_global_selection')
+
+        # Back calculate the relaxation data.
+        self.interpreter.relax_data.back_calc('NOE_500.001', ri_type='NOE', 
frq=500.001e6)
+
+        # The actual data.
+        ri_data_bc = [{'NOE_500.001': 0.52064607759431081},
+                      {'NOE_500.001': 0.57759452179767434}]
+
+        # Loop over the spins.
+        index = 0
+        for spin in spin_loop():
+            # Check the back calculated data.
+            self.assertEqual(spin.ri_data_bc, ri_data_bc[index])
+
+            # Increment.
+            index += 1