r23644 - /branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/r23644 - /branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/Author: bugman Date: Thu Jun 5 08:51:23 2014 New Revision: 23644 URL: http://svn.gna.org/viewcvs/relax?rev=23644&view=rev Log: Expanded the CaM pseudo-ellipse test data frame_order.py optimisation script. The optimisation is now implemented as in the auto-analysis, with an iterative increase in accuracy of the quasi-random numerical integration together with an decrease of the function tolerance cutoff for optimisation. The accuracy of the initial chi-squared calculation is now much higher. And the accuracy of the initial grid search and the Monte Carlo simulations is now much lower. The results of the new optimisation are included. Added: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos.pdb.gz (with props) branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_fixed_piv.pdb.gz (with props) branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_true.pdb.gz (with props) Removed: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos.pdb branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_fixed_piv.pdb branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_true.pdb Modified: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.bz2 branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.log.bz2 branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.pdb.gz branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.py branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order_fixed_piv.pdb.gz branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order_true.pdb.gz [This mail would be too long, it was shortened to contain the URLs only.] Removed: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos.pdb URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos.pdb?rev=23643&view=auto Added: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos.pdb.gz URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos.pdb.gz?rev=23644&view=auto Removed: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_fixed_piv.pdb URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_fixed_piv.pdb?rev=23643&view=auto Added: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_fixed_piv.pdb.gz URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_fixed_piv.pdb.gz?rev=23644&view=auto Removed: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_true.pdb URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_true.pdb?rev=23643&view=auto Added: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_true.pdb.gz URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/ave_pos_true.pdb.gz?rev=23644&view=auto Modified: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.bz2 URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.bz2?rev=23644&r1=23643&r2=23644&view=diff Modified: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.log.bz2 URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.log.bz2?rev=23644&r1=23643&r2=23644&view=diff Modified: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.pdb.gz URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.pdb.gz?rev=23644&r1=23643&r2=23644&view=diff Modified: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.py URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order.py?rev=23644&r1=23643&r2=23644&view=diff Modified: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order_fixed_piv.pdb.gz URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order_fixed_piv.pdb.gz?rev=23644&r1=23643&r2=23644&view=diff Modified: branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order_true.pdb.gz URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/pseudo_ellipse/frame_order_true.pdb.gz?rev=23644&r1=23643&r2=23644&view=diff