Author: semor
Date: Mon Dec 1 20:23:44 2008
New Revision: 8090
URL: http://svn.gna.org/viewcvs/relax?rev=8090&view=rev
Log:
Continued to add tests for the reading of an XEasy peak list.
Commented lines (154, 159, 162) refer to spins different than standard
backbone amides (HN - N),
i.e. HE1 - NE1
HN - C
HE1 - C
Not sure yet how to implement the reading of these...
Modified:
branches/spectral_errors/test_suite/system_tests/peak_lists.py
Modified: branches/spectral_errors/test_suite/system_tests/peak_lists.py
URL:
http://svn.gna.org/viewcvs/relax/branches/spectral_errors/test_suite/system_tests/peak_lists.py?rev=8090&r1=8089&r2=8090&view=diff
==============================================================================
--- branches/spectral_errors/test_suite/system_tests/peak_lists.py
(original)
+++ branches/spectral_errors/test_suite/system_tests/peak_lists.py Mon Dec
1 20:23:44 2008
@@ -151,4 +151,17 @@
self.assertEqual(cdp.mol[0].res[5].spin[0].intensities[0],
9.305e+03)
self.assertEqual(cdp.mol[0].res[6].spin[0].intensities[0],
3.154e+04)
self.assertEqual(cdp.mol[0].res[7].spin[0].intensities[0],
9.180e+03)
- self.assertEqual(cdp.mol[0].res[8].spin[0].intensities[0],
1.532e+04)
+ #self.assertEqual(cdp.mol[0].res[8].spin[0].intensities[0],
1.532e+04)
+ self.assertEqual(cdp.mol[0].res[9].spin[0].intensities[0],
1.104e+04)
+ self.assertEqual(cdp.mol[0].res[10].spin[0].intensities[0],
7.680e+03)
+ self.assertEqual(cdp.mol[0].res[11].spin[0].intensities[0],
5.206e+03)
+ self.assertEqual(cdp.mol[0].res[12].spin[0].intensities[0],
2.863e+04)
+ #self.assertEqual(cdp.mol[0].res[13].spin[0].intensities[0],
6.877e+03)
+ self.assertEqual(cdp.mol[0].res[14].spin[0].intensities[0],
9.271e+03)
+ self.assertEqual(cdp.mol[0].res[15].spin[0].intensities[0],
7.919e+03)
+ #self.assertEqual(cdp.mol[0].res[15].spin[1].intensities[0],
7.123e+03)
+ self.assertEqual(cdp.mol[0].res[16].spin[0].intensities[0],
9.962e+03)
+ self.assertEqual(cdp.mol[0].res[17].spin[0].intensities[0],
1.260e+04)
+ self.assertEqual(cdp.mol[0].res[18].spin[0].intensities[0],
1.545e+04)
+ self.assertEqual(cdp.mol[0].res[19].spin[0].intensities[0],
1.963e+04)
+ self.assertEqual(cdp.mol[0].res[20].spin[0].intensities[0],
1.918e+04)
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