mail[bug #24218] The alignment lables printed out by the align_tensor.matrix_angles user function are incorrect.


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Posted by Edward d Auvergne on December 21, 2015 - 11:04:
URL:
  <http://gna.org/bugs/?24218>

                 Summary: The alignment lables printed out by the
align_tensor.matrix_angles user function are incorrect.
                 Project: relax
            Submitted by: bugman
            Submitted on: Mon 21 Dec 2015 10:04:21 AM UTC
                Category: relax's source code
Specific analysis category: N-state model (ensemble analysis)
                Priority: 5 - Normal
                Severity: 3 - Normal
                  Status: None
             Assigned to: bugman
         Originator Name: 
        Originator Email: 
             Open/Closed: Open
                 Release: 4.0.1
         Discussion Lock: Any
        Operating System: All systems

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Details:

For example, the following commands:

pipe.create('test', 'N-state')
align_tensor.init(tensor='A', align_id='A', params=(1, 1, 1, 1, 1))
align_tensor.init(tensor='B', align_id='A', params=(1, 1, 1, 1, 1))
align_tensor.init(tensor='C', align_id='A', params=(1, 1, 1, 1, 1))
align_tensor.matrix_angles(tensors=['B', 'C'])

Produce:

relax> align_tensor.matrix_angles(basis_set='matrix', tensors=['B', 'C'],
angle_units='deg', precision=1)
Standard inter-tensor matrix angles in degrees using the Euclidean inner
product divided by the Frobenius norms (theta =
arccos(<A1,A2>/(||A1||.||A2||))):

     A           B           
A         0.0         0.0    
B         0.0         0.0




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