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SVN archive Commit Log


Commit Date  
[r8209] by bugman

Partial bug fix for the lactose N-state model system test.

The bond vector returning function for the internal PDB reader was converting the atom_id to
uppercase. This meant that molecule name corresponding to the file name was not matching!

2008-12-12 10:24:10 Tree
[r8208] by bugman

Fixes for the lactose PDB file reading system tests. The path to the files has changed!

2008-12-12 10:05:28 Tree
[r8207] by bugman

Activated the lactose N-state model system test.

2008-12-12 10:02:35 Tree
[r8206] by bugman

Added a system test script for the lactose N-state analysis using RDCs and PCSs.

2008-12-12 09:57:13 Tree
[r8205] by bugman

Added 10 tag PDB files for the lactose system test.

2008-12-12 09:56:09 Tree
[r8204] by bugman

Added some lactose RDC and PCS data. Note this is randomised and truncated for protection!!!

2008-12-12 09:47:28 Tree
[r8203] by bugman

Created a directory for storing alignment data such as RDCs and PCSs.

2008-12-12 09:44:12 Tree
[r8202] by bugman

Added 3 more lactose structures.

2008-12-12 09:31:12 Tree
[r8201] by bugman

Shifted the lactose structure into the lactose directory.

2008-12-12 09:29:31 Tree
[r8200] by bugman

Created a directory for putting a number of lactose structures into.

2008-12-12 09:28:59 Tree
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