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Commit Date  
[r8725] by bugman

Duplicated 5 systems tests of the internal PDB reader for the Scientific python PDB reader.

2009-02-04 09:33:25 Tree
[r8724] by semor

A small fix to the system test.

However, is this fix the solution or is there something wrong with the reading of data (such as
'R2eff') by relax_data.read() ?

Shouldn't the data, for example 'R2eff', be available in 'cdp.mol[0].res[0].spin[0].R2eff_val[0]'
or 'cdp.mol[0].res[0].spin[0].R2eff[0]' for the 1st spin of the 1st residue in the 1st molecule ?

2009-02-03 23:27:26 Tree
[r8723] by bugman

Wrote 2 new system tests for the new structural data design.

In test_read_pdb_internal6(), 2 different structures are loaded as 2 molecules. In
test_read_pdb_internal7(), 2 identical structures are loaded as 2 molecules.

2009-02-03 17:05:58 Tree
[r8722] by semor

Added a missing import.

2009-02-02 23:10:59 Tree
[r8721] by semor

Added more to the docstring.

This is not complete yet...

2009-02-02 23:10:20 Tree
[r8720] by semor

Reordered a few functions for alphabetical reasons.

2009-02-02 23:01:37 Tree
[r8719] by semor

Removed the obsolete function 'relax_disp.r2eff_read()'.

R2eff values will be read directly by 'relax_data.read()' (see r8702 and r8703).

2009-02-02 22:55:37 Tree
[r8718] by bugman

Merged revisions 8717 via svnmerge from
svn+ssh://bugman@.../svn/relax/1.3

........
r8717 | bugman | 2009-02-02 11:30:54 +0100 (Mon, 02 Feb 2009) | 11 lines

Fixed an annoying bug in the RelaxError debugging mode.

The problem here is that the relax state was being saved in the __init__() methods if in debug mode.
The result was that in try statements which catch and allow for RelaxErrors, the relax state was
being saved even though the error message and exception was suppressed. The fix was to shift the
state saving code into the __str__() method.

A side effect of this change is a simplification of all the RelaxError classes as the debug code is
no longer duplicated in each class.
........

2009-02-02 10:32:41 Tree
[r8717] by bugman

Fixed an annoying bug in the RelaxError debugging mode.

The problem here is that the relax state was being saved in the __init__() methods if in debug mode.
The result was that in try statements which catch and allow for RelaxErrors, the relax state was
being saved even though the error message and exception was suppressed. The fix was to shift the
state saving code into the __str__() method.

A side effect of this change is a simplification of all the RelaxError classes as the debug code is
no longer duplicated in each class.

2009-02-02 10:30:54 Tree
[r8716] by bugman

Modified __base_data_types() to include NOE restraints.

2009-02-02 10:05:21 Tree
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