mailr8629 - /branches/multi_structure/test_suite/system_tests/structure.py


Others Months | Index by Date | Thread Index
>>   [Date Prev] [Date Next] [Thread Prev] [Thread Next]

Header


Content

Posted by edward on January 23, 2009 - 11:43:
Author: bugman
Date: Fri Jan 23 11:43:09 2009
New Revision: 8629

URL: http://svn.gna.org/viewcvs/relax?rev=8629&view=rev
Log:
A number of fixes for test_read_pdb_complex_internal().


Modified:
    branches/multi_structure/test_suite/system_tests/structure.py

Modified: branches/multi_structure/test_suite/system_tests/structure.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/multi_structure/test_suite/system_tests/structure.py?rev=8629&r1=8628&r2=8629&view=diff
==============================================================================
--- branches/multi_structure/test_suite/system_tests/structure.py (original)
+++ branches/multi_structure/test_suite/system_tests/structure.py Fri Jan 23 
11:43:09 2009
@@ -1,6 +1,6 @@
 
###############################################################################
 #                                                                            
 #
-# Copyright (C) 2008 Edward d'Auvergne                                       
 #
+# Copyright (C) 2008-2009 Edward d'Auvergne                                  
 #
 #                                                                            
 #
 # This file is part of the program relax.                                    
 #
 #                                                                            
 #
@@ -22,6 +22,7 @@
 
 # Python module imports.
 import sys
+from os import sep
 from unittest import TestCase
 
 # relax module imports.
@@ -309,10 +310,10 @@
 
         # Read the PDB models.
         
self.relax.interpreter._Structure.read_pdb(file='gromacs_phthalic_acid.pdb', 
dir=path, parser='internal')
-        
self.relax.interpreter._Structure.read_pdb(file='lactose/lactose_MCMM4_S1_1.pdb',
 dir=path, parser='internal', set_model_num=1)
-        
self.relax.interpreter._Structure.read_pdb(file='lactose/lactose_MCMM4_S1_2.pdb',
 dir=path, parser='internal', set_model_num=2)
-        
self.relax.interpreter._Structure.read_pdb(file='lactose/lactose_MCMM4_S1_3.pdb',
 dir=path, parser='internal', set_model_num=1)
-        
self.relax.interpreter._Structure.read_pdb(file='lactose/lactose_MCMM4_S1_4.pdb',
 dir=path, parser='internal', set_model_num=2)
+        
self.relax.interpreter._Structure.read_pdb(file='lactose/lactose_MCMM4_S1_1.pdb',
 dir=path, parser='internal', set_model_num=1, 
set_mol_name='lactose_MCMM4_S1')
+        
self.relax.interpreter._Structure.read_pdb(file='lactose/lactose_MCMM4_S1_2.pdb',
 dir=path, parser='internal', set_model_num=2, 
set_mol_name='lactose_MCMM4_S1')
+        
self.relax.interpreter._Structure.read_pdb(file='lactose/lactose_MCMM4_S1_3.pdb',
 dir=path, parser='internal', set_model_num=1, 
set_mol_name='lactose_MCMM4_S1b')
+        
self.relax.interpreter._Structure.read_pdb(file='lactose/lactose_MCMM4_S1_4.pdb',
 dir=path, parser='internal', set_model_num=2, 
set_mol_name='lactose_MCMM4_S1b')
 
         # Try loading a few protons.
         self.relax.interpreter._Structure.load_spins('@*H*')
@@ -337,7 +338,8 @@
         models = [[1, 1, 1], [2, 1, 1]]
 
         for i in range(len(cdp.structure.structural_data)):
-            for j in range(len(model.mol)):
+            for j in range(len(cdp.structure.structural_data[i].mol)):
+                mol = cdp.structure.structural_data[i].mol[j]
                 self.assertEqual(mol.file_name, files[i][j])
                 self.assertEqual(mol.file_path, paths[i][j])
                 self.assertEqual(mol.file_model, models[i][j])




Related Messages


Powered by MHonArc, Updated Fri Jan 23 15:40:03 2009