Author: bugman Date: Tue Feb 14 19:19:16 2012 New Revision: 15333 URL: http://svn.gna.org/viewcvs/relax?rev=15333&view=rev Log: Updated the frame order test model optimisation statistics tables. Modified: branches/frame_order_testing/test_suite/shared_data/frame_order/cam/opt_stats Modified: branches/frame_order_testing/test_suite/shared_data/frame_order/cam/opt_stats URL: http://svn.gna.org/viewcvs/relax/branches/frame_order_testing/test_suite/shared_data/frame_order/cam/opt_stats?rev=15333&r1=15332&r2=15333&view=diff ============================================================================== --- branches/frame_order_testing/test_suite/shared_data/frame_order/cam/opt_stats (original) +++ branches/frame_order_testing/test_suite/shared_data/frame_order/cam/opt_stats Tue Feb 14 19:19:16 2012 @@ -4,55 +4,74 @@ Quadratic integration (from numpy) ---------------------------------- -Data set RDC + PCS RDC PCS -rigid 0.0784083092318 ? ? -rotor ? ? ? -rotor2 ? ? ? -rotor_2_state ? ? ? -free_rotor ? ? ? -free_rotor2 ? ? ? -iso_cone ? ? ? -iso_cone_free_rotor ? ? ? -iso_cone_free_rotor2 ? ? ? -iso_cone_torsionless ? ? ? -pseudo_ellipse ? ? ? -pseudo_ellipse_free_rotor ? ? ? -pseudo_ellipse_torsionless ? ? ? +Data set RDC + PCS RDC PCS +rigid 0.0784083092318 ? ? +rotor ? ? ? +rotor2 ? ? ? +rotor_2_state ? ? ? +free_rotor ? ? ? +free_rotor2 ? ? ? +iso_cone ? ? ? +iso_cone_free_rotor ? ? ? +iso_cone_free_rotor2 ? ? ? +iso_cone_torsionless ? ? ? +pseudo_ellipse ? ? ? +pseudo_ellipse_free_rotor ? ? ? +pseudo_ellipse_torsionless ? ? ? Monte Carlo integration (old relax code) ---------------------------------------- -Data set RDC + PCS RDC PCS -rigid 0.0784083092318 ? ? -rotor 0.159097903383 ? ? -rotor2 ? ? ? -rotor_2_state ? ? ? -free_rotor 11.970932909 ? ? -free_rotor2 389.389222372 ? ? -iso_cone 6.31501550972 ? ? -iso_cone_free_rotor ? ? ? -iso_cone_free_rotor2 ? ? ? -iso_cone_torsionless 79161.8338624 ? ? -pseudo_ellipse 3.73003376255 ? ? -pseudo_ellipse_free_rotor 16.6432491662 ? ? -pseudo_ellipse_torsionless 2.00525072929 ? ? +Data set RDC + PCS RDC PCS +rigid 0.0784083092318 ? ? +rotor 0.159097903383 ? ? +rotor2 ? ? ? +rotor_2_state ? ? ? +free_rotor 11.970932909 ? ? +free_rotor2 389.389222372 ? ? +iso_cone 6.31501550972 ? ? +iso_cone_free_rotor ? ? ? +iso_cone_free_rotor2 ? ? ? +iso_cone_torsionless 79161.8338624 ? ? +pseudo_ellipse 3.73003376255 ? ? +pseudo_ellipse_free_rotor 16.6432491662 ? ? +pseudo_ellipse_torsionless 2.00525072929 ? ? Quasi-random integration (from relax, 50 Sobol' pts) ---------------------------------------------------- -Data set RDC + PCS RDC PCS -rigid 0.08117725043308886 1.62132398885e-06 0.0811756291091 -rotor 0.5337786112501045 0.1460413756923267 0.38773723555777778 -rotor2 4.505100269246 0.260243918876 4.24485635037 -rotor_2_state ? ? ? -free_rotor 18.19765307215 5.17902126915 13.018631803 -free_rotor2 394.1767902138 5.2780738618 388.898716352 -iso_cone (100 pts) 40.370619886771799 6.1160690302975809 34.254550856474211 -iso_cone_free_rotor 91.81929629487 2.55339343957 89.2659028553 -iso_cone_free_rotor2 27.04106736869 1.95519413809 25.0858732306 -iso_cone_torsionless 89142.72228781572 86901.935712935723 2240.78657488 -pseudo_ellipse 42.27471263314 0.593794695247 41.6809179379 -pseudo_ellipse_free_rotor 215.155595458372 0.248965094372 214.906630364 -pseudo_ellipse_torsionless 2.231703479693 0.484168123653 1.74753535604 +Data set RDC + PCS RDC PCS +rigid 0.08117725043308886 1.62132398885e-06 0.0811756291091 +rotor 0.37635143856354297 0.1460413756923267 0.23031006287118444 +rotor2 4.505100269246 0.260243918876 4.24485635037 +rotor_2_state ? ? ? +free_rotor 18.214149909640394 5.17902126915 13.035128640494337 +free_rotor2 394.1767902138 5.2780738618 388.898716352 +iso_cone (100 pts) 13.624047293184548 6.1160690302975809 7.5079782628867333 +iso_cone_free_rotor 37.360496622266673 5.8864210784754025 31.474075543791272 +iso_cone_free_rotor2 27.04106736869 1.95519413809 25.0858732306 +iso_cone_torsionless 166.93408738938717 0.419922373339 166.51416501604808 +pseudo_ellipse 42.27471263314 0.593794695247 41.6809179379 +pseudo_ellipse_free_rotor 215.155595458372 0.248965094372 214.906630364 +pseudo_ellipse_torsionless 2.231703479693 0.484168123653 1.74753535604 + + +Quasi-random integration (from relax, 1e6 Sobol' pts) +-------------------------------------------------------- + +Data set RDC + PCS RDC PCS +rigid ? ? ? +rotor ? ? 0.19818574794847829 +rotor2 ? ? ? +rotor_2_state ? ? ? +free_rotor ? ? ? +free_rotor2 ? ? ? +iso_cone ? 6.1160690302975809 6.919712859834366 +iso_cone_free_rotor ? ? ? +iso_cone_free_rotor2 ? ? ? +iso_cone_torsionless ? ? 612.? +pseudo_ellipse ? ? ? +pseudo_ellipse_free_rotor ? ? ? +pseudo_ellipse_torsionless ? ? ?