mailr14351 - /1.3/test_suite/system_tests/structure.py


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Posted by hasu on August 11, 2011 - 15:14:
Author: han87
Date: Thu Aug 11 15:14:27 2011
New Revision: 14351

URL: http://svn.gna.org/viewcvs/relax?rev=14351&view=rev
Log:
Debugging in the system test 'test_read_xyz_internal2'

The code was changed for extracting an unit vector instead of a non unit 
vector. 

Modified:
    1.3/test_suite/system_tests/structure.py

Modified: 1.3/test_suite/system_tests/structure.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/test_suite/system_tests/structure.py?rev=14351&r1=14350&r2=14351&view=diff
==============================================================================
--- 1.3/test_suite/system_tests/structure.py (original)
+++ 1.3/test_suite/system_tests/structure.py Thu Aug 11 15:14:27 2011
@@ -689,7 +689,6 @@
 
         # Extract a vector between first two spins.
         self.interpreter.structure.vectors(attached='@10', spin_id='@2')
-        self.assertAlmostEqual(a.bond_vect[0], -2.162)
-        self.assertAlmostEqual(a.bond_vect[1], 3.274)
-        self.assertAlmostEqual(a.bond_vect[2], -3.518)
-
+        self.assertAlmostEqual(a.bond_vect[0], -0.4102707)
+        self.assertAlmostEqual(a.bond_vect[1], 0.62128879)
+        self.assertAlmostEqual(a.bond_vect[2], -0.6675913)




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