mailr25220 - /trunk/test_suite/system_tests/scripts/relax_disp/exp_fit.py


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Posted by tlinnet on August 22, 2014 - 15:22:
Author: tlinnet
Date: Fri Aug 22 15:22:38 2014
New Revision: 25220

URL: http://svn.gna.org/viewcvs/relax?rev=25220&view=rev
Log:
Fix for systemtest Relax_disp.test_exp_fit(), where the spin.isotope was not 
set.

The new call to return_r2eff_arrays(), when producing graphs, raise 
RelaxSpinTypeError() if no isotope is set.

bug #22461(https://gna.org/bugs/?22461): NS R1rho 2-site_fit_r1 has extremely 
high chi2 value in systemtest Relax_disp.test_r1rho_kjaergaard_missing_r1.

Modified:
    trunk/test_suite/system_tests/scripts/relax_disp/exp_fit.py

Modified: trunk/test_suite/system_tests/scripts/relax_disp/exp_fit.py
URL: 
http://svn.gna.org/viewcvs/relax/trunk/test_suite/system_tests/scripts/relax_disp/exp_fit.py?rev=25220&r1=25219&r2=25220&view=diff
==============================================================================
--- trunk/test_suite/system_tests/scripts/relax_disp/exp_fit.py (original)
+++ trunk/test_suite/system_tests/scripts/relax_disp/exp_fit.py Fri Aug 22 
15:22:38 2014
@@ -42,6 +42,9 @@
 spin.create(res_name='Asp', res_num=1, spin_name='N')
 spin.create(res_name='Gly', res_num=2, spin_name='N')
 spin.create(res_name='Lys', res_num=3, spin_name='N')
+
+# Name the isotope for field strength scaling.
+spin.isotope(isotope='15N')
 
 # The spectral data - spectrum ID, peak lists, offset frequency (Hz), 
relaxation time period (s), baseplane RMSD estimate.
 data = [




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