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SVN archive Commit Log


Commit Date  
[r8519] by bugman

Bug fixes for the calls to __atom_index().

2009-01-19 12:24:24 Tree
[r8518] by bugman

Bug fix for the pack_structs() method. The wrong index was being used!

2009-01-19 12:21:04 Tree
[r8517] by bugman

Bug fix for the MolList.add_item() method.

2009-01-19 10:52:37 Tree
[r8516] by bugman

Fix for the MolList.is_empty() method.

If the molecule container method is_empty() is missing, then the container is assumed to not be
empty (i.e. the case for the Scientific python objects).

2009-01-19 10:51:50 Tree
[r8515] by bugman

Added the is_empty() method.

2009-01-19 10:50:59 Tree
[r8514] by bugman

Fixes for the unpacking of the __residue_loop() results.

2009-01-19 10:39:32 Tree
[r8513] by bugman

Fixed the calls to __residue_loop().

2009-01-19 10:37:28 Tree
[r8512] by bugman

Removed all dependence on the deleted __molecule_loop() method.

2009-01-19 10:36:33 Tree
[r8511] by bugman

Bug fix for bond_vectors(), the molecule name was not correctly accessed.

2009-01-19 10:27:36 Tree
[r8510] by bugman

Modified __bonded_atom() and __find_bonded_atoms() for the new structural object design.

2009-01-19 10:24:12 Tree
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