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Commit Date  
[r27732] by bugman

Expansion of the Rdc.test_rdc_copy_different_spins system test.

The interatomic data containers are now defined via the interatom.define user function, which
requires the spin.element user function to set up the element information. A printout has also been
added to demonstrate a failure in the pipe_control.interatomic.interatomic_loop() function in
handling the correct data pipe.

2015-03-02 17:09:12 Tree
[r27731] by bugman

Another small fix for the new Rdc.test_rdc_copy_different_spins system test.

The rdc.copy user function requires the pipe_to argument to be supplied in this case.

2015-03-02 16:27:21 Tree
[r27730] by bugman

Some more fixes for the Rdc.test_rdc_copy_different_spins system test.

The residue.delete and not spin.delete user function is required to delete the sequence data.

2015-03-02 16:24:08 Tree
[r27729] by bugman

Copyright update.

2015-03-02 16:21:19 Tree
[r27728] by bugman

Added a printout to the sequence.attach_protons user function listing all the newly created spins.

2015-03-02 16:21:04 Tree
[r27727] by bugman

Copyright update.

2015-03-02 16:16:56 Tree
[r27726] by bugman

Simplification of the new Rdc.test_rdc_copy_different_spins system test.

This no longer tests the deletion of interatomic data containers by the spin.delete user function,
something which is not implemented.

2015-03-02 16:16:44 Tree
[r27725] by bugman

Created a system test to show a limitation of the rdc.copy user function.

Currently, it cannot work when spin systems in two data pipes are different. The system test will
be used to implement the support.

2015-03-02 15:55:08 Tree
[r27724] by bugman

Fix for the rdc.write user function.

The check for the missing rdc_data_types variable in the interatomic containers is now more
comprehensive and checks for the presence of the alignment ID.

2015-03-02 14:34:59 Tree
[r27723] by bugman

Bug fix for the results.write user function when loading relax state files.

The results.write user function can load not only the results file consisting of a single data pipe,
but also relax state files if only a single pipe is present. However this was causing the current
data pipe and other pipe-independent data (sequence alignments and the GUI) to be overwritten, just
as when loading a state file. Now only the data from the data pipe will be loaded and the pipe
independent data in the state file will be ignored.

2015-03-02 14:32:59 Tree
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