Menu

SVN archive Commit Log


Commit Date  
[r14869] by bugman

Fix for a problem introduced at r14810 - relax uses D and not 2D internally for the RDCs.

This is only a problem if the rdc.read 'data_type' argument is used. This is only a few days old so
will affect no one!

2011-10-14 08:21:50 Tree
[r14868] by bugman

Fix for the paramag.centre user function when a numpy array is used.

2011-10-13 16:31:08 Tree
[r14867] by bugman

Some last fixes, hopefully, for the N-state model code.

2011-10-12 17:32:04 Tree
[r14866] by bugman

Removed the Q factor calculations from metal_pos_opt.py as they should already be calculated.

2011-10-12 17:31:40 Tree
[r14865] by bugman

Clean up of the metal_pos_opt.py system test script.

2011-10-12 17:16:18 Tree
[r14864] by bugman

Fixes for the N-state model optimisation set up if PCS or RDC data is not loaded.

2011-10-12 17:12:19 Tree
[r14863] by bugman

Revert the reversion of revision r14853 which was a reversion of r14849, as it was ok!

The command used was:
svn merge -r14853:r14852 .

.....
Reverted r14849 as this was not the correct solution to the problem!

The command used was:
svn merge -r14849:r14848 .

.....
r14849 | bugman | 2011-10-12 17:40:47 +0200 (Wed, 12 Oct 2011) | 5 lines
Changed paths:
M /1.3/maths_fns/n_state_model.py

Yet another fix for the N-state model target functions.

The Ln3+ optimisation with the tensors fixed was resulting in a chi2 value of 0 at all times!
.....
.....

2011-10-12 17:07:04 Tree
[r14862] by bugman

More fixes and improvements to the test_metal_pos_opt() system test.

2011-10-12 17:01:27 Tree
[r14861] by bugman

Reverted the last revision (r14860) as the change was rubbish.

The command used was:
svn merge -r14860:r14859 .

2011-10-12 16:57:31 Tree
[r14860] by bugman

Fix for the position checking in the metal_pos_opt.py script.

2011-10-12 16:54:49 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.