mailr7993 - /branches/spectral_errors/test_suite/system_tests/peak_lists.py


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Posted by edward on November 20, 2008 - 23:31:
Author: bugman
Date: Thu Nov 20 23:31:32 2008
New Revision: 7993

URL: http://svn.gna.org/viewcvs/relax?rev=7993&view=rev
Log:
Fixes for the 4 peak list reading system tests.

The spin specific intensities structure is now a simple list.


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=7993&r1=7992&r2=7993&view=diff
==============================================================================
--- branches/spectral_errors/test_suite/system_tests/peak_lists.py (original)
+++ branches/spectral_errors/test_suite/system_tests/peak_lists.py Thu Nov 20 
23:31:32 2008
@@ -64,7 +64,7 @@
         
self.relax.interpreter._Spectrum.read_intensities(file="generic.txt", 
dir=sys.path[-1] + "/test_suite/shared_data/peak_lists", spectrum_id='test', 
int_method='heights')
 
         # Test the data.
-        self.assertEqual(cdp.mol[0].res[0].spin[0].intensities[0][0], 1.0000)
+        self.assertEqual(cdp.mol[0].res[0].spin[0].intensities[0], 1.0000)
 
 
     def test_read_peak_list_nmrview(self):
@@ -82,8 +82,8 @@
         self.relax.interpreter._Spectrum.read_intensities(file="cNTnC.xpk", 
dir=sys.path[-1] + "/test_suite/shared_data/peak_lists", spectrum_id='test', 
int_method='heights')
 
         # Test the data.
-        self.assertEqual(cdp.mol[0].res[0].spin[0].intensities[0][0], 
-0.1694)
-        self.assertEqual(cdp.mol[0].res[1].spin[0].intensities[0][0], 
-0.1142)
+        self.assertEqual(cdp.mol[0].res[0].spin[0].intensities[0], -0.1694)
+        self.assertEqual(cdp.mol[0].res[1].spin[0].intensities[0], -0.1142)
 
 
     def test_read_peak_list_sparky(self):
@@ -103,10 +103,10 @@
         
self.relax.interpreter._Spectrum.read_intensities(file="ref_ave.list", 
dir=sys.path[-1] + "/test_suite/shared_data/peak_lists", spectrum_id='test', 
int_method='heights')
 
         # Test the data.
-        self.assertEqual(cdp.mol[0].res[0].spin[0].intensities[0][0], 6262)
-        self.assertEqual(cdp.mol[0].res[1].spin[0].intensities[0][0], 148614)
-        self.assertEqual(cdp.mol[0].res[2].spin[0].intensities[0][0], 166842)
-        self.assertEqual(cdp.mol[0].res[3].spin[0].intensities[0][0], 128690)
+        self.assertEqual(cdp.mol[0].res[0].spin[0].intensities[0], 6262)
+        self.assertEqual(cdp.mol[0].res[1].spin[0].intensities[0], 148614)
+        self.assertEqual(cdp.mol[0].res[2].spin[0].intensities[0], 166842)
+        self.assertEqual(cdp.mol[0].res[3].spin[0].intensities[0], 128690)
 
 
     def test_read_peak_list_xeasy(self):
@@ -143,12 +143,12 @@
         
self.relax.interpreter._Spectrum.read_intensities(file="xeasy_r1_20ms.text", 
dir=sys.path[-1] + "/test_suite/shared_data/peak_lists", spectrum_id='test', 
int_method='heights')
 
         # Test the data.
-        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)
-        self.assertEqual(cdp.mol[0].res[2].spin[0].intensities[0][0], 
1.356e+04)
-        self.assertEqual(cdp.mol[0].res[3].spin[0].intensities[0][0], 
9.884e+03)
-        self.assertEqual(cdp.mol[0].res[4].spin[0].intensities[0][0], 
2.041e+04)
-        self.assertEqual(cdp.mol[0].res[5].spin[0].intensities[0][0], 
9.305e+03)
-        self.assertEqual(cdp.mol[0].res[6].spin[0].intensities[0][0], 
3.154e+04)
-        self.assertEqual(cdp.mol[0].res[7].spin[0].intensities[0][0], 
9.180e+03)
-        self.assertEqual(cdp.mol[0].res[8].spin[0].intensities[0][0], 
1.532e+04)
+        self.assertEqual(cdp.mol[0].res[0].spin[0].intensities[0], 9.714e+03)
+        self.assertEqual(cdp.mol[0].res[1].spin[0].intensities[0], 7.919e+03)
+        self.assertEqual(cdp.mol[0].res[2].spin[0].intensities[0], 1.356e+04)
+        self.assertEqual(cdp.mol[0].res[3].spin[0].intensities[0], 9.884e+03)
+        self.assertEqual(cdp.mol[0].res[4].spin[0].intensities[0], 2.041e+04)
+        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)




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