r8734 - /1.3/test_suite/system_tests/structure.py -- February 04, 2009 - 17:32

Author: bugman
Date: Wed Feb  4 17:32:36 2009
New Revision: 8734

URL: http://svn.gna.org/viewcvs/relax?rev=8734&view=rev
Log:
Fix for the test_read_pdb_complex_scientific() system test.

Retarded Scientific python splitting a perfectly good molecule into 2 when it 
can't recognise a
residue type!


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=8734&r1=8733&r2=8734&view=diff
==============================================================================
--- 1.3/test_suite/system_tests/structure.py (original)
+++ 1.3/test_suite/system_tests/structure.py Wed Feb  4 17:32:36 2009
@@ -576,10 +576,10 @@
 
         # Read the PDB models.
         
self.relax.interpreter._Structure.read_pdb(file='gromacs_phthalic_acid.pdb', 
dir=path, parser='scientific')
-        
self.relax.interpreter._Structure.read_pdb(file='lactose/lactose_MCMM4_S1_1.pdb',
 dir=path, parser='scientific', 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='scientific', 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='scientific', 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='scientific', set_model_num=2, 
set_mol_name='lactose_MCMM4_S1b')
+        
self.relax.interpreter._Structure.read_pdb(file='lactose/lactose_MCMM4_S1_1.pdb',
 dir=path, parser='scientific', read_mol=1, 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='scientific', read_mol=1, 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='scientific', read_mol=1, 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='scientific', read_mol=1, set_model_num=2, 
set_mol_name='lactose_MCMM4_S1b')
 
         # Try loading a few protons.
         self.relax.interpreter._Structure.load_spins('@*H*')