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SVN archive Commit Log


Commit Date  
[r5848] by bugman

Removed the heteronuc arg test of the structure.vectors() user function.

This argument is no longer present.

2008-04-20 15:09:08 Tree
[r5847] by bugman

Fixed all the unit tests of generic_fns.selection.generate_spin_id_data_array().

The function was recently renamed from generate_spin_id() to generate_spin_id_data_array().

2008-04-20 15:08:02 Tree
[r5846] by bugman

Wrote the test_Selection_full_spin_id() for testing the string identifier '#Ap4Aase:2&:Glu@...&@NH'.

2008-04-20 15:04:43 Tree
[r5845] by bugman

Added the start of the regular expression description in the id_string_doc string.

2008-04-20 15:03:46 Tree
[r5844] by bugman

Fix for the atom_id string.

2008-04-20 12:45:30 Tree
[r5843] by bugman

Started to write the new structural API method attached_atom().

2008-04-20 12:45:03 Tree
[r5842] by bugman

Started to recode the vectors() function.

The structural API atom_loop() approach is completely wrong, so the spin_loop() will be used
instead.

2008-04-20 12:30:59 Tree
[r5841] by bugman

The full spin info is now returned from return_spin() and the modified spins written to stdout.

2008-04-20 11:36:54 Tree
[r5840] by bugman

Added the full_info flag arg to return_spin() to allow more info to be returned when desired.

This flag will cause the molecule name, residue number and residue name to be returned in addition
to the spin container.

2008-04-20 11:32:46 Tree
[r5839] by bugman

Deleted the xh_vector() method from the API base class and Scientific Python PDB data object.

2008-04-20 11:27:34 Tree
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