Author: bugman
Date: Mon Jan 26 11:29:38 2015
New Revision: 27298
URL: http://svn.gna.org/viewcvs/relax?rev=27298&view=rev
Log:
Reintroduced the CONECT PDB records into the artificial diffusion tensor test
suite data.
The uniform vector distributions have overlapping vectors. This causes the
internal structural
object atom connection determining algorithm to fail, as this is distance-based
rather than using
the PDB amino acid definitions for now.
Modified:
trunk/test_suite/shared_data/diffusion_tensor/ellipsoid/uniform.pdb
trunk/test_suite/shared_data/diffusion_tensor/generate_data.py
trunk/test_suite/shared_data/diffusion_tensor/sphere/uniform.pdb
trunk/test_suite/shared_data/diffusion_tensor/spheroid/uniform.pdb
[This mail would be too long, it was shortened to contain the URLs only.]
Modified: trunk/test_suite/shared_data/diffusion_tensor/ellipsoid/uniform.pdb
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/diffusion_tensor/ellipsoid/uniform.pdb?rev=27298&r1=27297&r2=27298&view=diff
Modified: trunk/test_suite/shared_data/diffusion_tensor/generate_data.py
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/diffusion_tensor/generate_data.py?rev=27298&r1=27297&r2=27298&view=diff
Modified: trunk/test_suite/shared_data/diffusion_tensor/sphere/uniform.pdb
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/diffusion_tensor/sphere/uniform.pdb?rev=27298&r1=27297&r2=27298&view=diff
Modified: trunk/test_suite/shared_data/diffusion_tensor/spheroid/uniform.pdb
URL:
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/diffusion_tensor/spheroid/uniform.pdb?rev=27298&r1=27297&r2=27298&view=diff
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