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Merged revisions 18542-18544 via svnmerge from

svn+ssh://bugman@.../svn/relax/trunk

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r18542 | bugman | 2013-02-20 17:05:25 +0100 (Wed, 20 Feb 2013) | 6 lines

The diffusion tensor PDB files are now conform better to the PDB standard.

The HET records are now correct, only capitalised text is present in the files, and trailing
whitespace to character 80 has been added.
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r18543 | bugman | 2013-02-20 17:17:53 +0100 (Wed, 20 Feb 2013) | 5 lines

Fix for the generic_fns.structure.pdb_write.ter() function.

Whitespace to character 80 is now being added to the TER PDB records.
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r18544 | bugman | 2013-02-20 17:20:17 +0100 (Wed, 20 Feb 2013) | 6 lines

Fix for the creation of the FORMUL PDB records by the internal structural object.

The component number is now set to the index of the hetrogen plus one. This number should have been
a sequential number starting at 1 and is not related to the residue number in any way.
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bugman 2013-02-20

changed /branches/frame_order_testing
changed /branches/frame_order_testing/generic_fns/structure/internal.py
changed /branches/frame_order_testing/generic_fns/structure/pdb_write.py
changed /branches/frame_order_testing/test_suite/shared_data/structures/diff_tensors/ellipsoid.pdb
changed /branches/frame_order_testing/test_suite/shared_data/structures/diff_tensors/sphere.pdb
changed /branches/frame_order_testing/test_suite/shared_data/structures/diff_tensors/spheroid.pdb
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