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[r20333] by bugman

Added the 'NS 2-site' model to the relax_disp.select_model user function frontend.

This is the model of the numerical solution for the 2-site Bloch-McConnell equations. It originates
as optimization function number 1 from the fitting_main_kex.py script from Mathilde Lescanne, Paul
Schanda, and Dominique Marion (see http://thread.gmane.org/gmane.science.nmr.relax.devel/4138,
https://gna.org/task/?7712#comment2 and https://gna.org/support/download.php?file_id=18262).

This commit follows step 2 of the relaxation dispersion model addition tutorial
(http://thread.gmane.org/gmane.science.nmr.relax.devel/3907).

2013-07-16 12:45:20 Tree
[r20332] by bugman

Added the 'NS 2-site' model to the specific_analyses.relax_disp.variables module.

This is the model of the numerical solution for the 2-site Bloch-McConnell equations. It originates
as optimization function number 1 from the fitting_main_kex.py script from Mathilde Lescanne, Paul
Schanda, and Dominique Marion (see http://thread.gmane.org/gmane.science.nmr.relax.devel/4138,
https://gna.org/task/?7712#comment2 and https://gna.org/support/download.php?file_id=18262).

This commit follows step 1 of the relaxation dispersion model addition tutorial
(http://thread.gmane.org/gmane.science.nmr.relax.devel/3907).

2013-07-16 12:43:01 Tree
[r20331] by bugman

Fix for the Relax_disp.test_hansen_cpmg_data_auto_analysis system test for model name change.

This is for the change from the 'CR72' model to 'CR72 red' model.

2013-07-16 12:05:53 Tree
[r20330] by bugman

Improvements for the write_results() method of the dispersion auto-analysis.

The parameter value and Grace files are now correctly created for all the recent models.

2013-07-16 11:43:55 Tree
[r20329] by bugman

Added support for model nesting in the relaxation dispersion auto-analysis.

This involves copying the parameters from the simpler nested model rather than performing a full
grid search. This is currently used to handle all models with R20A and R20B parameters where a
simpler model with the single R20 parameter is optimised first.

2013-07-16 10:11:53 Tree
[r20328] by bugman

Small speed up for the lib.dispersion.cr72 module for the R20A != R20B case.

Replicated calculations have been minimised.

2013-07-16 09:17:47 Tree
[r20327] by bugman

Documentation fix for the lib.dispersion.cr72 module.

2013-07-16 09:14:19 Tree
[r20326] by bugman

Better printouts of the R20A and R20B parameters at the end of minimisation.

2013-07-16 09:13:24 Tree
[r20325] by bugman

Fix for the dispersion specific loop_parameters() method for the R20A and R20B parameters.

The frequency index is now correctly returned for these and the R20 parameter.

2013-07-16 09:06:50 Tree
[r20324] by bugman

Expanded the CR72 model to handle both the R20A and R20B parameters.

The 'CR72 red' model now functions as the old CR72 model where R20A = R20B = R20. All parts of the
code have been modified. The lib.dispersion.cr72.r2eff_CR72() function has been expanded to support
the full Carver and Richards 1972 equations, dropping back to the simplified form if R20A = R20B.

2013-07-16 08:56:17 Tree
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