mailr8081 - /branches/spectral_errors/sample_scripts/relax_fit.py


Others Months | Index by Date | Thread Index
>>   [Date Prev] [Date Next] [Thread Prev] [Thread Next]

Header


Content

Posted by edward on December 01, 2008 - 15:59:
Author: bugman
Date: Mon Dec  1 15:59:05 2008
New Revision: 8081

URL: http://svn.gna.org/viewcvs/relax?rev=8081&view=rev
Log:
Manually updated the relax_fit.py sample script to match the equivalent 
system test script.


Modified:
    branches/spectral_errors/sample_scripts/relax_fit.py

Modified: branches/spectral_errors/sample_scripts/relax_fit.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/spectral_errors/sample_scripts/relax_fit.py?rev=8081&r1=8080&r2=8081&view=diff
==============================================================================
--- branches/spectral_errors/sample_scripts/relax_fit.py (original)
+++ branches/spectral_errors/sample_scripts/relax_fit.py Mon Dec  1 15:59:05 
2008
@@ -98,12 +98,15 @@
 # Save the relaxation rates.
 value.write(param='rx', file='rx.out', force=True)
 
+# Save the results.
+results.write(file='results', force=True)
+
 # Create Grace plots of the data.
 grace.write(y_data_type='chi2', file='chi2.agr', force=True)    # Minimised 
chi-squared value.
 grace.write(y_data_type='i0', file='i0.agr', force=True)    # Initial peak 
intensity.
 grace.write(y_data_type='rx', file='rx.agr', force=True)    # Relaxation 
rate.
-grace.write(x_data_type='relax_times', y_data_type='ave_int', 
file='intensities.agr', force=True)    # Average peak intensities.
-grace.write(x_data_type='relax_times', y_data_type='ave_int', norm=True, 
file='intensities_norm.agr', force=True)    # Average peak intensities 
(normalised).
+grace.write(x_data_type='relax_times', y_data_type='int', 
file='intensities.agr', force=True)    # Average peak intensities.
+grace.write(x_data_type='relax_times', y_data_type='int', norm=True, 
file='intensities_norm.agr', force=True)    # Average peak intensities 
(normalised).
 
 # Display the Grace plots.
 grace.view(file='chi2.agr')
@@ -113,4 +116,4 @@
 grace.view(file='intensities_norm.agr')
 
 # Save the program state.
-state.save(file='rx.save', force=True)
+state.save('rx.save', force=True)




Related Messages


Powered by MHonArc, Updated Mon Dec 01 16:20:02 2008