mailr22147 - in /branches/double_rotor: ./ devel_scripts/ test_suite/system_tests/ test_suite/system_tests/scripts/n_state_model/


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Posted by edward on February 07, 2014 - 11:34:
Author: bugman
Date: Fri Feb  7 11:33:59 2014
New Revision: 22147

URL: http://svn.gna.org/viewcvs/relax?rev=22147&view=rev
Log:
Merged revisions 22139,22143-22144 via svnmerge from 
svn+ssh://bugman@xxxxxxxxxxx/svn/relax/trunk

........
  r22139 | bugman | 2014-02-06 16:17:49 +0100 (Thu, 06 Feb 2014) | 6 lines
  
  Small improvement for the devel_scripts/python_seek.py script.
  
  The list of detected Python binaries files are now sorted prior to 
determining the installed
  modules.
........
  r22143 | bugman | 2014-02-07 11:11:55 +0100 (Fri, 07 Feb 2014) | 8 lines
  
  Updated the N_state_model.5_state_xz system test to allow it to complete on 
i586 Linux systems.
  
  The optimisation would continue for a huge amount of time on a test system 
(Mageia 4 i586 VM) and
  would make it appear as though the test suite has hung.  By limiting the 
maximum number of
  iterations in the optimisation to 1000, the test will complete successfully 
and the parameters
  optimised to the same precision.
........
  r22144 | bugman | 2014-02-07 11:17:55 +0100 (Fri, 07 Feb 2014) | 5 lines
  
  Loosened the checks for the Frame_order.test_korzhnev_2005_15n_zq_data 
system test.
  
  This is to allow the test to pass on a 32-bit test system (Mageia 4 i586 
VM).
........

Modified:
    branches/double_rotor/   (props changed)
    branches/double_rotor/devel_scripts/python_seek.py
    branches/double_rotor/test_suite/system_tests/relax_disp.py
    
branches/double_rotor/test_suite/system_tests/scripts/n_state_model/5_state_xz.py

Propchange: branches/double_rotor/
------------------------------------------------------------------------------
--- svnmerge-integrated (original)
+++ svnmerge-integrated Fri Feb  7 11:33:59 2014
@@ -1,1 +1,1 @@
-/trunk:1-22112,22115-22118,22125-22138
+/trunk:1-22112,22115-22118,22125-22144

Modified: branches/double_rotor/devel_scripts/python_seek.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/double_rotor/devel_scripts/python_seek.py?rev=22147&r1=22146&r2=22147&view=diff
==============================================================================
--- branches/double_rotor/devel_scripts/python_seek.py (original)
+++ branches/double_rotor/devel_scripts/python_seek.py Fri Feb  7 11:33:59 
2014
@@ -121,6 +121,9 @@
             # Add the file, avoiding duplicates.
             if file not in binaries:
                 binaries.append(file)
+
+        # Sort the list.
+        binaries.sort()
 
         # Return the file list.
         return binaries

Modified: branches/double_rotor/test_suite/system_tests/relax_disp.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/double_rotor/test_suite/system_tests/relax_disp.py?rev=22147&r1=22146&r2=22147&view=diff
==============================================================================
--- branches/double_rotor/test_suite/system_tests/relax_disp.py (original)
+++ branches/double_rotor/test_suite/system_tests/relax_disp.py Fri Feb  7 
11:33:59 2014
@@ -1815,7 +1815,7 @@
         self.assertAlmostEqual(spin.r2[r20_key3], 6.78922219135537, 2)
         self.assertAlmostEqual(spin.pA, 0.942457332074014, 4)
         self.assertAlmostEqual(spin.dw, 0.850592422908884, 1)
-        self.assertAlmostEqual(spin.dwH, 0.0881272284455416, 3)
+        self.assertAlmostEqual(spin.dwH, 0.0881272284455416, 2)
         self.assertAlmostEqual(spin.kex/1000, 372.745483351305/1000, 3)
         self.assertAlmostEqual(spin.chi2, 23.8464637019392, 1)
 

Modified: 
branches/double_rotor/test_suite/system_tests/scripts/n_state_model/5_state_xz.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/double_rotor/test_suite/system_tests/scripts/n_state_model/5_state_xz.py?rev=22147&r1=22146&r2=22147&view=diff
==============================================================================
--- 
branches/double_rotor/test_suite/system_tests/scripts/n_state_model/5_state_xz.py
 (original)
+++ 
branches/double_rotor/test_suite/system_tests/scripts/n_state_model/5_state_xz.py
 Fri Feb  7 11:33:59 2014
@@ -72,7 +72,7 @@
 #self._execute_uf(uf_name='value.set')
 
 # Minimise.
-self._execute_uf('simplex', constraints=False, uf_name='minimise')
+self._execute_uf('simplex', constraints=False, uf_name='minimise', 
max_iter=1000)
 
 # Centre of mass analysis.
 self._execute_uf(uf_name='n_state_model.CoM', pivot_point=[0.0, 0.0, 0.0], 
centre=[0.0, 0.0, 1.0])




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