Menu

SVN archive Commit Log


Commit Date  
[r16870] by bugman

Updated another N-state model system test script to the new rdc.read interatomic data design.

2012-06-11 20:26:03 Tree
[r16869] by bugman

The generic_fns.interatomic.create_interatom() function now returns the created container.

This comes from the InteratomicContainer.add_item() method which now also returns the container.

2012-06-11 20:25:24 Tree
[r16868] by bugman

Missing imports.

2012-06-11 19:07:40 Tree
[r16867] by bugman

Renamed the interatomic function return_container() to return_interatom().

This is to make the name more unique.

2012-06-11 19:06:51 Tree
[r16866] by bugman

Bug fix for a segmentation fault occurring during the model-free GUI test.

Flushing of the interpreter queue object is needed as some parts of the interface use asynchronous
user function calls.

2012-06-11 19:05:16 Tree
[r16865] by bugman

Shifted some code from InteratomList.add_item() to generic_fns.interatomic.create_interatom().

This is to break a circular import problem.

2012-06-11 19:03:50 Tree
[r16864] by bugman

The rdc.read user function backend is now adding the RDCs to the interatomic data containers.

2012-06-11 19:01:22 Tree
[r16863] by bugman

Created the generic_fns.interatomic.create_interatom() function for creating interatomic data containers.

2012-06-11 18:57:56 Tree
[r16862] by bugman

Added checks to the InteratomList.add_item() method to make sure that the spin IDs already exist.

2012-06-11 18:56:57 Tree
[r16861] by bugman

Fix for the InteratomList.add_item() method.

2012-06-11 18:55:27 Tree
Older >
Want the latest updates on software, tech news, and AI?
Get latest updates about software, tech news, and AI from SourceForge directly in your inbox once a month.