mailr7702 - /1.3/test_suite/system_tests/xeasy.py


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Posted by sebastien . morin . 1 on October 15, 2008 - 00:01:
Author: semor
Date: Wed Oct 15 00:01:04 2008
New Revision: 7702

URL: http://svn.gna.org/viewcvs/relax?rev=7702&view=rev
Log:
Continued the implementation of the XEasy support system test.

Much more work is needed, though.


Modified:
    1.3/test_suite/system_tests/xeasy.py

Modified: 1.3/test_suite/system_tests/xeasy.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/test_suite/system_tests/xeasy.py?rev=7702&r1=7701&r2=7702&view=diff
==============================================================================
--- 1.3/test_suite/system_tests/xeasy.py (original)
+++ 1.3/test_suite/system_tests/xeasy.py Wed Oct 15 00:01:04 2008
@@ -52,13 +52,32 @@
         cdp = pipes.get_pipe()
 
         # Create the sequence data, and name the spins.
+        self.relax.interpreter._Residue.create(15)
+        self.relax.interpreter._Residue.create(21)
+        self.relax.interpreter._Residue.create(22)
+        self.relax.interpreter._Residue.create(29)
+        self.relax.interpreter._Residue.create(52)
+        self.relax.interpreter._Residue.create(69)
         self.relax.interpreter._Residue.create(70)
-        self.relax.interpreter._Residue.create(72)
+        self.relax.interpreter._Residue.create(73)
+        self.relax.interpreter._Residue.create(79)
+        self.relax.interpreter._Residue.create(84)
+        self.relax.interpreter._Residue.create(87)
+        self.relax.interpreter._Residue.create(95)
+        self.relax.interpreter._Residue.create(96)
+        self.relax.interpreter._Residue.create(100)
+        self.relax.interpreter._Residue.create(104)
+        self.relax.interpreter._Residue.create(107)
+        self.relax.interpreter._Residue.create(110)
+        self.relax.interpreter._Residue.create(112)
+        self.relax.interpreter._Residue.create(120)
+        self.relax.interpreter._Residue.create(141)
+        self.relax.interpreter._Residue.create(165)
         self.relax.interpreter._Spin.name(name='N')
 
         # Read the peak list.
-        self.relax.interpreter._Relax_fit.read(file="cNTnC.xpk", 
dir=sys.path[-1] + "/test_suite/shared_data/peak_lists", relax_time=0.0176, 
format='xeasy')
+        self.relax.interpreter._Relax_fit.read(file="xeasy_r1_20ms.text", 
dir=sys.path[-1] + "/test_suite/shared_data/peak_lists", relax_time=0.020, 
format='xeasy')
 
         # Test the data.
-        self.assertEqual(cdp.mol[0].res[0].spin[0].intensities[0][0], 
-6.88333129883)
-        self.assertEqual(cdp.mol[0].res[1].spin[0].intensities[0][0], 
-5.49038267136)
+        self.assertEqual(cdp.mol[0].res[0].spin[0].intensities[0][0], 
9.714e+03)
+        self.assertEqual(cdp.mol[0].res[1].spin[0].intensities[0][0], 
7.919e+03)




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