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SVN archive Commit Log


Commit Date  
[r21594] by bugman

Fix for the 'MQ CR72' dispersion model target function.

The correct R20 values are now extracted from the parameter vector.

2013-11-22 07:50:06 Tree
[r21593] by bugman

Removed a latent bug in the 'MMQ 2-site' dispersion model.

This was not being seen but might have caused problems in the future.

2013-11-21 21:50:28 Tree
[r21592] by bugman

Fixes for the 'MQ CR72' dispersion model target function.

2013-11-21 21:48:28 Tree
[r21591] by bugman

The relax_disp.plot_disp_curves user function can now handle values of NaN.

These are simply replaced by 0.0 to allow Grace to open the file.

2013-11-21 21:45:18 Tree
[r21590] by bugman

Another bug fix for the 'MQ CR72' dispersion model.

The nu_CPMG value rather than the relaxation time was being used to calculate the R2eff values as
the division by 'n' was missing.

2013-11-21 21:31:40 Tree
[r21589] by bugman

Fix for the 'MQ CR72' model for MQ-type data.

The check to prevent acos of a number less than 1 has been changed to switch the sign rather than to
set the back calculated R2eff to 1e99.

2013-11-21 21:17:06 Tree
[r21588] by bugman

Converted the 'MQ CR72' dispersion model to handle MMQ data.

This model can now handle proton-heteronuclear SQ, ZQ, DQ, and MQ CPMG-type data. Some debugging
might still be required.

2013-11-21 20:59:57 Tree
[r21587] by bugman

Bug fix for the 'MMQ 2-site' dispersion model target function.

The relaxation time was being taken as that of the first experiment for all experiments. This is a
relic from the code being copied from a single experiment type model.

2013-11-21 16:50:31 Tree
[r21586] by bugman

The relax_disp.plot_disp_curves now shows the experiment type as part of the Y-axis label.

This is to allow for easy identification of the experiment when more than one is present.

2013-11-21 16:16:05 Tree
[r21585] by bugman

Fixes for the relax_disp.plot_exp_curves user function for the lib.software.grace changes.

2013-11-21 16:10:30 Tree
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