Menu

SVN archive Commit Log


Commit Date  
[r21870] by bugman

Speed up of the 'TP02' and 'NS R1rho 2-site' dispersion models.

Repetitive calculations have been minimised.

2013-12-08 18:47:59 Tree
[r21869] by bugman

Updated and reformatted the dispersion software comparison document.

2013-12-08 15:26:43 Tree
[r21868] by bugman

Updated the NESSY results for the truncated CPMG data from Flemming Hansen.

This now uses the data from all residues to allow for a proper error analysis so the results are
comparable to all the other software.

2013-12-08 13:13:04 Tree
[r21867] by bugman

Updated the relax results for the truncated CPMG data from Flemming Hansen.

This includes the new results for the 'MMQ CR72' model. The analysis uses more model nesting. And
the Grace plots now include the interpolation graphs (hence the plots are now bzip2 compressed).

2013-12-08 12:15:01 Tree
[r21866] by bugman

The 'LM63' and 'LM63 3-site' models are now classified as nested in the dispersion auto-analysis.

The grid search for the 'LM63 3-site' model is therefore skipped and the starting parameters for
optimisation are set to those of the optimised 'LM63' model.

2013-12-08 11:32:35 Tree
[r21865] by bugman

Fix for a typo in the previous commit (r21864).

2013-12-08 11:22:42 Tree
[r21864] by bugman

Fix for the relax_disp.plot_disp_curves user function.

The interpolated curves now have all invalid points of 1e100 removed from the graph. This allows
for reasonable graph scaling.

2013-12-08 11:19:01 Tree
[r21863] by bugman

Fix for the previous commmit (r21862).

Nested model parameters can only be copied if they exist.

2013-12-08 11:11:02 Tree
[r21862] by bugman

The 'CR72' and 'MMQ CR72' models are now classified as nested in the dispersion auto-analysis.

The grid search for the 'MMQ CR72' model will therefore be skipped and the parameters taken from the
'CR72' model. This will however rarely, if ever, be used.

2013-12-08 08:54:42 Tree
[r21861] by bugman

Updated more test suite scripts to call the relax_disp.cpmg_frq user function.

2013-12-08 08:48:46 Tree
Older >
Want the latest updates on software, tech news, and AI?
Get latest updates about software, tech news, and AI from SourceForge directly in your inbox once a month.