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[r22861] by tlinnet

Extended systemtest for -s Relax_disp.test_sod1wt_t25_set_grid_r20_from_min_r2eff.

Feature request: #3151, (https://gna.org/support/index.php?3151) - User function to set the R20 parameters in the default grid search using the minimum R2eff value.

The systemtest now both test the creation of the correct values, the running of grid_search, and the auto_analysis.

2014-04-25 17:15:32 Tree
[r22860] by tlinnet

Fix for skipping grid search, when set parameter values are of dict() type.

Feature request: #3151, (https://gna.org/support/index.php?3151) - User function to set the R20 parameters in the default grid search using the minimum R2eff value.

2014-04-25 17:15:29 Tree
[r22859] by tlinnet

Added relax_disp.set_grid_r20_from_min_r2eff functionality to relax disp auto_analyses.

Feature request: #3151, (https://gna.org/support/index.php?3151) - User function to set the R20 parameters in the default grid search using the minimum R2eff value.

2014-04-25 17:15:27 Tree
[r22858] by tlinnet

Modified systemtest to use user function instead.

Feature request: #3151, (https://gna.org/support/index.php?3151) - User function to set the R20 parameters in the default grid search using the minimum R2eff value.

2014-04-25 15:24:18 Tree
[r22857] by tlinnet

Added user function: relax_disp.set_grid_r20_from_min_r2eff.

Feature request: #3151, (https://gna.org/support/index.php?3151) - User function to set the R20 parameters in the default grid search using the minimum R2eff value.

2014-04-25 15:24:16 Tree
[r22856] by tlinnet

Extended api value.set to use index in value setting.

Feature request: #3151, (https://gna.org/support/index.php?3151) - User function to set the R20 parameters in the default grid search using the minimum R2eff value.

The index used is expected to match the spectrometer frequency.

2014-04-25 13:38:06 Tree
[r22855] by tlinnet

Added systemtest for setting R20 from minimum R2eff before grid search.

Feature request: #3151, (https://gna.org/support/index.php?3151) - User function to set the R20 parameters in the default grid search using the minimum R2eff value.

Systemtest: -s Relax_disp.test_sod1wt_t25_set_grid_r20_from_min_r2eff.

2014-04-25 13:38:04 Tree
[r22854] by tlinnet

Added function to find minimum R2eff value to set as R20 value before grid search.

Feature request: #3151, (https://gna.org/support/index.php?3151) - User function to set the R20 parameters in the default grid search using the minimum R2eff value.

2014-04-25 13:38:01 Tree
[r22853] by bugman

Changed the bounds for the R20 parameters in the default grid search.

The range of 1 to 40 rad.s^-1 was previous used. This has been narrowed to 5 to 20.

2014-04-24 15:38:33 Tree
[r22852] by bugman

Large speed up of the relaxation dispersion system tests by about 20%.

This was achieved by turning the grid search off in the following system tests:
Relax_disp.test_hansen_cpmg_data_auto_analysis
Relax_disp.test_hansen_cpmg_data_auto_analysis_numeric
Relax_disp.test_hansen_cpmg_data_auto_analysis_r2eff
Relax_disp.test_hansen_cpmg_data_missing_auto_analysis
Relax_disp.test_m61_exp_data_to_m61

Some of the optimisation values are slightly different, or completely different for the one example
of the CR72 model fitted to no exchange, and these have been updated in the tests.

2014-04-24 14:46:17 Tree
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