Commit | Date | |
---|---|---|
[r26428]
by
bugman
Updated all the calculated 1st degree frame order matrix graphs for the pseudo-ellipse. The changes are due to the fixes in the lib.frame_order.pseudo_ellipse module. |
2014-11-06 14:49:09 | Tree |
[r26427]
by
bugman
Simplifications and fixes for the 1st degree frame order matrix calculation for the pseudo-ellipse. The compile_1st_matrix_pseudo_ellipse() function of the lib.frame_order.pseudo_ellipse module has |
2014-11-06 14:48:03 | Tree |
[r26426]
by
bugman
Added the free rotor model to the frame order matrix element simulation script. The generated in-frame and out-of-frame Grace graphs containing the matrix values for 1,000,000 |
2014-11-06 13:07:28 | Tree |
[r26425]
by
bugman
Added the rotor model to the frame order matrix element simulation script. The generated in-frame and out-of-frame Grace graphs containing the matrix values for 1,000,000 |
2014-11-06 12:47:49 | Tree |
[r26424]
by
bugman
The frame order matrix element simulation script now uses the Kronecker outer product. This allows the frame order matrix to be in the same notation as that used internally in relax. It |
2014-11-03 07:31:48 | Tree |
[r26423]
by
bugman
Simulation of the pseudo-ellipse frame order matrix elements. This is for a simulation of 1,000,000 states for each angle increment, and includes in-frame and |
2014-11-03 07:18:07 | Tree |
[r26422]
by
bugman
The frame_order_simulate.py script now uses lib.text.progress.progress_meter(). This script for simulating the frame order matrix elements now uses the standard progress meter in |
2014-11-02 21:45:56 | Tree |
[r26421]
by
bugman
A minor speed up for the frame_order_simulate.py script. The angles are now being calculated at the very start prior to the main loop, removing repetitive |
2014-11-02 21:45:54 | Tree |
2014-11-02 21:14:59 | Tree | |
[r26419]
by
bugman
Created the Grace graphs for the free rotor isotropic cone 1st degree frame order matrix elements. These are the values calculated directly from the lib.frame_order modules. The graphs were |
2014-11-02 21:14:57 | Tree |