relax SVN archive

Molecular dynamics by NMR data analysis

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SVN archive Commit Log

Commit	Date
[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
[r14859] by bugman More attempts at fixing the N-state model code.......	2011-10-12 16:54:15	Tree
[r14858] by bugman Added a check that the chi2 value is no longer zero if the Ln3+ is moved in the metal_pos_opt.py test.	2011-10-12 16:31:16	Tree
[r14857] by bugman Added another chi2 of zero check to the metal_pos_opt.py system test script.	2011-10-12 16:22:29	Tree
[r14856] by bugman The chi2 of zero test in the metal_pos_opt.py system test script is now not exact.	2011-10-12 16:19:28	Tree
[r14855] by bugman A fix for the previous fixes for the metal position optimisation test data!	2011-10-12 16:17:56	Tree
[r14854] by bugman Fixes for the metal position optimisation test data. The RDCs and PCSs were 3 times too large!	2011-10-12 16:16:05	Tree
[r14853] by bugman 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 15:59:41	Tree

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