mailr21088 - /branches/relax_disp/test_suite/system_tests/scripts/relax_disp/sprangers_data.py


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Posted by edward on October 14, 2013 - 13:56:
Author: bugman
Date: Mon Oct 14 13:56:29 2013
New Revision: 21088

URL: http://svn.gna.org/viewcvs/relax?rev=21088&view=rev
Log:
Added some value.set calls to the 
Relax_disp.test_sprangers_cpmg_data_auto_analysis system test.

These user function calls will be used to test a new concept of fixing 
parameters in the grid
search.  The dw and dwH parameters are fixed to the experimental values, as 
described in the README
file from Remco Sprangers (in 
test_suite/shared_data/dispersion/Sprangers_ClpP).


Modified:
    
branches/relax_disp/test_suite/system_tests/scripts/relax_disp/sprangers_data.py

Modified: 
branches/relax_disp/test_suite/system_tests/scripts/relax_disp/sprangers_data.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/relax_disp/test_suite/system_tests/scripts/relax_disp/sprangers_data.py?rev=21088&r1=21087&r2=21088&view=diff
==============================================================================
--- 
branches/relax_disp/test_suite/system_tests/scripts/relax_disp/sprangers_data.py
 (original)
+++ 
branches/relax_disp/test_suite/system_tests/scripts/relax_disp/sprangers_data.py
 Mon Oct 14 13:56:29 2013
@@ -107,6 +107,12 @@
 spectrum.replicated(spectrum_ids=['800_ncyc2', '800_ncyc2b'])
 spectrum.replicated(spectrum_ids=['800_ncyc3', '800_ncyc3b'])
 
+# Measured chemical shift differences.
+value.set(val=0.625, param='dw', spin_id=":135")
+value.set(val=0.033, param='dwH', spin_id=":135")
+value.set(val=0.981, param='dw', spin_id=":137")
+value.set(val=0.010, param='dwH', spin_id=":137")
+
 
 # Auto-analysis execution.
 ##########################




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