r8664 - /branches/ave_noe/test_suite/unit_tests/spin_testing_base.py -- January 27, 2009 - 13:47

Author: bugman
Date: Tue Jan 27 13:47:35 2009
New Revision: 8664

URL: http://svn.gna.org/viewcvs/relax?rev=8664&view=rev
Log:
Wrote a unit test for the creation of pseudo-atom spin containers.


Modified:
    branches/ave_noe/test_suite/unit_tests/spin_testing_base.py

Modified: branches/ave_noe/test_suite/unit_tests/spin_testing_base.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/ave_noe/test_suite/unit_tests/spin_testing_base.py?rev=8664&r1=8663&r2=8664&view=diff
==============================================================================
--- branches/ave_noe/test_suite/unit_tests/spin_testing_base.py (original)
+++ branches/ave_noe/test_suite/unit_tests/spin_testing_base.py Tue Jan 27 
13:47:35 2009
@@ -251,6 +251,37 @@
         self.assertRaises(RelaxError, self.spin_fns.copy, spin_from=':1', 
spin_to=':2@78')
 
 
+    def test_create_pseudo_spin(self):
+        """Test the creation of a pseudo-atom.
+
+        The function tested is both 
generic_fns.mol_res_spin.create_pseudo_spin() and
+        prompt.spin.create_pseudo().
+        """
+
+        # Create a few new protons.
+        self.spin_fns.create(100, 'H13', res_id='#Old mol:1')
+        self.spin_fns.create(101, 'H14', res_id='#Old mol:1')
+        self.spin_fns.create(102, 'H15', res_id='#Old mol:1')
+
+        # Create a few pseudo-spins.
+        self.spin_fns.create_pseudo('Q3', spin_num=105, members=['@H13', 
'@H14', '@H15'])
+
+        # Get the data pipe.
+        dp = pipes.get_pipe('orig')
+
+        # Test that the spin numbers are correct.
+        self.assertEqual(dp.mol[0].res[0].spin[5].num, 100)
+        self.assertEqual(dp.mol[0].res[0].spin[6].num, 101)
+        self.assertEqual(dp.mol[0].res[0].spin[7].num, 102)
+        self.assertEqual(dp.mol[0].res[0].spin[8].num, 105)
+
+        # Test that the spin names are correct.
+        self.assertEqual(dp.mol[0].res[0].spin[5].name, 'H13')
+        self.assertEqual(dp.mol[0].res[0].spin[6].name, 'H14')
+        self.assertEqual(dp.mol[0].res[0].spin[7].name, 'H15')
+        self.assertEqual(dp.mol[0].res[0].spin[8].name, 'Q3')
+
+
     def test_create_spin(self):
         """Test the creation of a spin.