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Commit Date  
[r21618] by bugman

Increased the range of chemical shift differences in the grid search for the dispersion models.

The range was too narrow.

2013-11-24 12:42:49 Tree
[r21617] by bugman

Updates for the dispersion auto-analysis system tests using Flemming Hansen's data.

The grid search increments have been increased by one to make sure the solution is always found.

2013-11-24 12:37:12 Tree
[r21616] by bugman

Updated the spin-lock field strength data structures to be experiment and field specific.

This allows different spin-locks to be used as different field strengths, or different experiments.
It brings the structures in line with those for CPMG-type experiments.

2013-11-24 12:09:02 Tree
[r21615] by bugman

Converted the dispersion api method _back_calc_r2eff() into a function of the optimisation module.

2013-11-23 17:23:15 Tree
[r21614] by bugman

Merged revisions 21613 via svnmerge from
svn+ssh://bugman@.../svn/relax/trunk

........
r21613 | bugman | 2013-11-22 19:33:54 +0100 (Fri, 22 Nov 2013) | 7 lines

Created the --numpy-raise command line option.

When this is set, all numpy warnings will be converted to errors. This is to aid in debugging to
locate where the warning messages are coming from. These appear as RelaxWarnings, but there is no
indication as to where the problem is.
........

2013-11-22 18:39:48 Tree
[r21613] by bugman

Created the --numpy-raise command line option.

When this is set, all numpy warnings will be converted to errors. This is to aid in debugging to
locate where the warning messages are coming from. These appear as RelaxWarnings, but there is no
indication as to where the problem is.

2013-11-22 18:33:54 Tree
[r21612] by bugman

The grid search for the MMQ-type models now looks for negative chemical shift differences.

2013-11-22 18:03:06 Tree
[r21611] by bugman

Fix for the legends in the Grace graphs produced by the relax_disp.plot_disp_curves user function.

2013-11-22 17:50:57 Tree
[r21610] by bugman

Fixes for all of the Relax_disp.test_korzhnev_2005_*_data system tests.

These now start optimising at the solution found by cpmg_fit. All tests now pass.

2013-11-22 17:45:35 Tree
[r21609] by bugman

Updated the Relax_disp.test_sprangers_data_to_mq_cr72 system test to pass.

The 'MQ CR72' model is now much more accurate due to a number of recent bug fixes.

2013-11-22 16:33:35 Tree
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