Author: bugman
Date: Wed Oct 22 15:39:47 2014
New Revision: 26355
URL: http://svn.gna.org/viewcvs/relax?rev=26355&view=rev
Log:
Modified the Structure.test_load_spins_multi_mol system test for the spin.pos
variable changes.
The atomic position for an ensemble of structures is now set to None rather
than being missing, so
the system test has been updated to check for this.
Modified:
trunk/test_suite/system_tests/structure.py
Modified: trunk/test_suite/system_tests/structure.py
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/system_tests/structure.py?rev=26355&r1=26354&r2=26355&view=diff
==============================================================================
--- trunk/test_suite/system_tests/structure.py (original)
+++ trunk/test_suite/system_tests/structure.py Wed Oct 22 15:39:47 2014
@@ -2953,10 +2953,11 @@
# Check the @C1 spin data.
self.assertEqual(cdp.mol[0].res[0].spin[0].name, 'C1')
self.assertEqual(cdp.mol[0].res[0].spin[0].num, None)
- self.assertEqual(len(cdp.mol[0].res[0].spin[0].pos), 1)
+ self.assertEqual(len(cdp.mol[0].res[0].spin[0].pos), 2)
self.assertEqual(cdp.mol[0].res[0].spin[0].pos[0][0], 6.250)
self.assertEqual(cdp.mol[0].res[0].spin[0].pos[0][1], 0.948)
self.assertEqual(cdp.mol[0].res[0].spin[0].pos[0][2], 1.968)
+ self.assertEqual(cdp.mol[0].res[0].spin[0].pos[1], None)
# Check the @C2 spin data.
self.assertEqual(cdp.mol[0].res[0].spin[1].name, 'C2')
@@ -2972,10 +2973,11 @@
# Check the @C3 spin data.
self.assertEqual(cdp.mol[0].res[0].spin[2].name, 'C3')
self.assertEqual(cdp.mol[0].res[0].spin[2].num, None)
- self.assertEqual(len(cdp.mol[0].res[0].spin[2].pos), 1)
- self.assertEqual(cdp.mol[0].res[0].spin[2].pos[0][0], 8.062)
- self.assertEqual(cdp.mol[0].res[0].spin[2].pos[0][1], 0.431)
- self.assertEqual(cdp.mol[0].res[0].spin[2].pos[0][2], 3.048)
+ self.assertEqual(len(cdp.mol[0].res[0].spin[2].pos), 2)
+ self.assertEqual(cdp.mol[0].res[0].spin[0].pos[0], None)
+ self.assertEqual(cdp.mol[0].res[0].spin[2].pos[1][0], 8.062)
+ self.assertEqual(cdp.mol[0].res[0].spin[2].pos[1][1], 0.431)
+ self.assertEqual(cdp.mol[0].res[0].spin[2].pos[1][2], 3.048)
def test_load_internal_results(self):
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