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Commit Date  
[r6961] by bugman

Fixes for the setup of the N-state model optimisation code.

2008-07-24 15:02:21 Tree
[r6960] by bugman

Fixes for the func_population() target function.

2008-07-24 15:00:43 Tree
[r6959] by bugman

Fixed the call to to_tensor().

2008-07-24 14:55:09 Tree
[r6958] by bugman

Fixed the setting up of optimisation of the population N-state model.

2008-07-24 14:54:46 Tree
[r6957] by bugman

Spelling fix for the word 'indices'.

2008-07-24 13:22:13 Tree
[r6956] by bugman

Another spelling fix for 'indices'.

2008-07-24 13:20:08 Tree
[r6955] by bugman

Merged revisions 6954 via svnmerge from
svn+ssh://bugman@.../svn/relax/1.3

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r6954 | bugman | 2008-07-24 15:16:47 +0200 (Thu, 24 Jul 2008) | 3 lines

Global spelling fix for the word 'indices'.
........

2008-07-24 13:18:19 Tree
[r6954] by bugman

Global spelling fix for the word 'indices'.

2008-07-24 13:16:47 Tree
[r6953] by bugman

Merged revisions 6939-6940,6946-6951 via svnmerge from
svn+ssh://bugman@.../svn/relax/1.3

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r6939 | semor | 2008-07-11 15:13:22 +0200 (Fri, 11 Jul 2008) | 8 lines

Started the modification from 'devnull' to tempfiles.

This is as proposed by Edward d'Auvergne to catch the creation of a well formatted and non empty
tensor pdb file and was discussed in a post at:
https://mail.gna.org/public/relax-devel/2008-07/msg00029.html (message ID:
7f080ed10807081248r1f0fda8axd17768bb841efe71@...)
........
r6940 | bugman | 2008-07-16 18:50:15 +0200 (Wed, 16 Jul 2008) | 3 lines

Made the spin_name arg optional in the spin.create() user function.
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r6946 | bugman | 2008-07-24 13:59:45 +0200 (Thu, 24 Jul 2008) | 3 lines

Improvements to the chi-squared value, gradient, and Hessian docstrings.
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r6947 | bugman | 2008-07-24 14:20:02 +0200 (Thu, 24 Jul 2008) | 9 lines

Overhaul of the chi-squared gradient and Hessian functions.

The original functions have been renamed to dchi2_element and d2chi2_element as these calculate the
gradient for element j and the Hessian for element {j, k}. Two new functions, dchi2 and d2chi2 have
been written to calculate the full gradient and Hessian in one function call.

These changes will temporarily break a lot of code!
........
r6948 | bugman | 2008-07-24 14:37:10 +0200 (Thu, 24 Jul 2008) | 3 lines

Fixed the model-free optimisation code to use the dchi2_element and d2chi2_element functions.
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r6949 | bugman | 2008-07-24 14:45:23 +0200 (Thu, 24 Jul 2008) | 5 lines

Fixed the unit tests for dchi2_element and d2chi2_element.

Two new unit tests have been added for the dchi2 and d2chi2 functions as well.
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r6950 | bugman | 2008-07-24 14:46:16 +0200 (Thu, 24 Jul 2008) | 3 lines

Added some missing imports.
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r6951 | bugman | 2008-07-24 14:46:31 +0200 (Thu, 24 Jul 2008) | 3 lines

Removed some old code.
........

2008-07-24 12:50:06 Tree
[r6952] by bugman

A lot of modifications to the population N-state model optimisation code.

2008-07-24 12:49:13 Tree
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