mailr8580 - /branches/multi_structure/test_suite/system_tests/scripts/tylers_peptide.py


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Posted by edward on January 22, 2009 - 11:28:
Author: bugman
Date: Thu Jan 22 11:28:02 2009
New Revision: 8580

URL: http://svn.gna.org/viewcvs/relax?rev=8580&view=rev
Log:
Fixes for the system test catching Tyler Reddy's bug report at 
https://gna.org/bugs/?12487.


Modified:
    branches/multi_structure/test_suite/system_tests/scripts/tylers_peptide.py

Modified: 
branches/multi_structure/test_suite/system_tests/scripts/tylers_peptide.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/multi_structure/test_suite/system_tests/scripts/tylers_peptide.py?rev=8580&r1=8579&r2=8580&view=diff
==============================================================================
--- 
branches/multi_structure/test_suite/system_tests/scripts/tylers_peptide.py 
(original)
+++ 
branches/multi_structure/test_suite/system_tests/scripts/tylers_peptide.py 
Thu Jan 22 11:28:02 2009
@@ -11,8 +11,8 @@
 results.read(file='tylers_peptide_trunc', dir=DATA_PATH+'results_files')
 model_free.remove_tm(spin_id=None)
 sequence.display()
-structure.read_pdb(file='tylers_peptide_trunc.pdb', 
dir=DATA_PATH+'structures', model=None, parser='scientific')
-structure.vectors(attached='H', spin_id=None, struct_index=None, 
verbosity=1, ave=True, unit=True)
+structure.read_pdb(file='tylers_peptide_trunc.pdb', 
dir=DATA_PATH+'structures', parser='scientific')
+structure.vectors(attached='H', spin_id=None, verbosity=1, ave=True, 
unit=True)
 diffusion_tensor.init(params=(1e-08, 0, 0, 0, 0, 0), time_scale=1.0, 
d_scale=1.0, angle_units='deg', param_types=0, spheroid_type=None, 
fixed=False)
 fix(element='all_spins', fixed=True)
 grid_search(lower=None, upper=None, inc=6, constraints=True, verbosity=1)




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