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SVN archive Commit Log


Commit Date  
[r3648] by bugman

Bug fix for the mol_to arg unit test of the molecule.copy() user function.

The relax_data_store data required was not being setup.

2007-11-20 10:46:34 Tree
[r3647] by bugman

Bug fix for the molecule.copy() user function.

The arg 'mol_to' can be None!

2007-11-20 10:40:37 Tree
[r3646] by bugman

Bug fix in the molecule.display() user function.

The test for None or a str should use 'and', not 'or'!

2007-11-20 10:38:13 Tree
[r3645] by bugman

generic_fns.residue is now placed into the namespace of the prompt.molecule unit tests.

2007-11-20 10:34:25 Tree
[r3644] by bugman

Another bug fix for the molecule.rename() user function.

The function generic_fns.molecule.create() was being called!!!

2007-11-20 10:31:28 Tree
[r3643] by bugman

Fixes and improvements to the docstring of the molecule.rename() user function.

2007-11-20 10:30:40 Tree
[r3642] by bugman

Bug fix in the molecule.rename() user function.

The mol_num argument does not exist, it should be mol_id!

2007-11-20 10:30:08 Tree
[r3641] by bugman

Removed the 2 molecule.renumber() tests (currently spin.renumber()) as molecules aren't numbered.

2007-11-20 10:27:32 Tree
[r3640] by bugman

Implemented the new_name arg unit test for the molecule.rename() user function.

2007-11-20 10:26:09 Tree
[r3639] by bugman

Bug fix for the molecule.rename() user function - mol_id should be a str not an int!

2007-11-20 10:25:18 Tree
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