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SVN archive Commit Log


Commit Date  
[r4911] by bugman

Converted the Molmol 'command_history' structure into a module variable.

2008-02-07 09:33:14 Tree
[r4910] by bugman

Huge redesign of the load_PDB_sequence() function (and converted it to the new relax design).

This new function should give much more flexibility and abstraction in the mapping from the
molecular structure to the relax mol-res-spin data structure.

2008-02-04 17:06:15 Tree
[r4909] by bugman

Finished converting the read_pdb() function to the new relax design.

2008-02-04 15:22:14 Tree
[r4908] by bugman

Converted the load_structures() function to the new relax design.

2008-02-04 15:19:41 Tree
[r4907] by bugman

Replaced all 'relax_data_store.pdb[run]' with 'cdp.structure'.

2008-02-04 15:08:29 Tree
[r4906] by bugman

Removed the adding of the 'run' to the 3D structure data structure.

2008-02-04 15:07:25 Tree
[r4905] by bugman

Deleted the SpecificData container as nothing now uses it.

2008-02-04 14:05:10 Tree
[r4904] by bugman

Changed the 3D structure data structure from a SpecificData class to the Element class.

2008-02-04 14:04:19 Tree
[r4903] by bugman

Removed an unused import of SpecificData.

2008-02-04 14:03:34 Tree
[r4902] by bugman

Updated all the tests of the read_pdb() function to the new relax design.

2008-02-04 13:54:07 Tree
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