r8242 - /branches/relax_disp/test_suite/system_tests/scripts/relax_disp.py -- January 06, 2009 - 22:23

Author: semor
Date: Tue Jan  6 22:23:46 2009
New Revision: 8242

URL: http://svn.gna.org/viewcvs/relax?rev=8242&view=rev
Log:
Reverted revision 8229.

The command used was:
svn merge -r8229:8228 .

This follows a message by Edward concerning the copying of existing code 
within relax:
https://mail.gna.org/public/relax-devel/2009-01/msg00006.html
(Message-id: <7f080ed10901061301w4fd295feu5a2af1a157153064@xxxxxxxxxxxxxx>)


Removed:
    branches/relax_disp/test_suite/system_tests/scripts/relax_disp.py

Removed: branches/relax_disp/test_suite/system_tests/scripts/relax_disp.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/relax_disp/test_suite/system_tests/scripts/relax_disp.py?rev=8241&view=auto
==============================================================================
--- branches/relax_disp/test_suite/system_tests/scripts/relax_disp.py 
(original)
+++ branches/relax_disp/test_suite/system_tests/scripts/relax_disp.py 
(removed)
@@ -1,96 +1,0 @@
-# Script for relaxation curve fitting.
-
-import sys
-
-
-# Create the data pipe.
-pipe.create('rx', 'relax_disp')
-
-# The path to the data files.
-data_path = sys.path[-1] + '/test_suite/shared_data/relax_disp'
-
-## Load the sequence.
-#sequence.read('Ap4Aase.seq', dir=sys.path[-1] + '/test_suite/shared_data')
-#
-## Name the spins so they can be matched to the assignments.
-#spin.name(name='N')
-#
-## Spectrum names.
-#names = [
-#    'T2_ncyc1_ave',
-#    'T2_ncyc1b_ave',
-#    'T2_ncyc2_ave',
-#    'T2_ncyc4_ave',
-#    'T2_ncyc4b_ave',
-#    'T2_ncyc6_ave',
-#    'T2_ncyc9_ave',
-#    'T2_ncyc9b_ave',
-#    'T2_ncyc11_ave',
-#    'T2_ncyc11b_ave'
-#]
-#
-## Relaxation times (in seconds).
-#times = [
-#    0.0176,
-#    0.0176,
-#    0.0352,
-#    0.0704,
-#    0.0704,
-#    0.1056,
-#    0.1584,
-#    0.1584,
-#    0.1936,
-#    0.1936
-#]
-#
-## Loop over the spectra.
-#for i in xrange(len(names)):
-#    # Load the peak intensities.
-#    spectrum.read_intensities(file=names[i]+'.list', dir=data_path, 
spectrum_id=names[i], int_method='height')
-#
-#    # Set the relaxation times.
-#    relax_fit.relax_time(time=times[i], spectrum_id=names[i])
-#
-## Specify the duplicated spectra.
-#spectrum.replicated(spectrum_ids=['T2_ncyc1_ave', 'T2_ncyc1b_ave'])
-#spectrum.replicated(spectrum_ids=['T2_ncyc4_ave', 'T2_ncyc4b_ave'])
-#spectrum.replicated(spectrum_ids=['T2_ncyc9_ave', 'T2_ncyc9b_ave'])
-#spectrum.replicated(spectrum_ids=['T2_ncyc11_ave', 'T2_ncyc11b_ave'])
-#
-## Peak intensity error analysis.
-#spectrum.error_analysis()
-#
-## Deselect unresolved spins.
-#deselect.read(file='unresolved', dir=data_path)
-#
-## Set the relaxation curve type.
-#relax_fit.select_model('exp')
-#
-## Grid search.
-#grid_search(inc=11)
-#
-## Minimise.
-#minimise('simplex', constraints=False)
-#
-## Monte Carlo simulations.
-#monte_carlo.setup(number=10)
-#monte_carlo.create_data()
-#monte_carlo.initial_values()
-#minimise('simplex', constraints=False)
-#monte_carlo.error_analysis()
-#
-## Save the relaxation rates.
-#value.write(param='rx', file='devnull', force=True)
-#
-## Save the results.
-#results.write(file='devnull', force=True)
-#
-## Create Grace plots of the data.
-#grace.write(y_data_type='chi2', file='devnull', force=True)    # Minimised 
chi-squared value.
-#grace.write(y_data_type='i0', file='devnull', force=True)    # Initial peak 
intensity.
-#grace.write(y_data_type='rx', file='devnull', force=True)    # Relaxation 
rate.
-#grace.write(x_data_type='relax_times', y_data_type='int', file='devnull', 
force=True)    # Average peak intensities.
-#grace.write(x_data_type='relax_times', y_data_type='int', norm=True, 
file='devnull', force=True)    # Average peak intensities (normalised).
-#
-## Save the program state.
-#state.save('devnull', force=True)