# created by ASDP Version 1.0 Copyright(C) 2010 # Fri May 10 17:58:30 2013 # Command: /farm/software/asdp/asdp-1.0-release/bin//../bin/noesyassign # -c /data/PSVS/PSVS-v1.4-dev/results/SR384_R3Cons_em_bcr3/rpf_calc/input/ctrl_file # -o rpf_calc # -q SR384_R3Cons_em_bcr3.pdb.iupac # Summary for n.peaks Total simulated peaks: 70 Number of peaks NOT matched in the Peak List: 70 M score = 1 Average shift in HX: nan Average ab-shift in HX: nan(Assignment used: 0) Average shift in X: nan Average ab-shift in X: nan(Assignment used: 0) Average shift in HX2: nan Average ab-shift in HX2: nan(Assignment used: 0) Input error: M-score > 0.5 # Summary for c_aro.peaks Total simulated peaks: 4 Number of peaks NOT matched in the Peak List: 0 M score = 0 Average shift in HX: 0.00075 Average ab-shift in HX: 0.00075(Assignment used: 2) Average shift in X: 0.005 Average ab-shift in X: 0.045(Assignment used: 2) Average shift in HX2: 0.0018 Average ab-shift in HX2: 0.0022(Assignment used: 4) #For peaklist c_aro.peaks: Rmax: 5 Model ave Inconsistent score: 0(0/35) Model 1 Inconsistent score: 0.0286(1/35) Model 2 Inconsistent score: 0(0/35) Model 3 Inconsistent score: 0(0/35) Model 4 Inconsistent score: 0(0/35) Model 5 Inconsistent score: 0.0286(1/35) Model 6 Inconsistent score: 0(0/35) Model 7 Inconsistent score: 0.0286(1/35) Model 8 Inconsistent score: 0(0/35) Model 9 Inconsistent score: 0.0286(1/35) Model 10 Inconsistent score: 0(0/35) Model 11 Inconsistent score: 0(0/35) Model 12 Inconsistent score: 0(0/35) Model 13 Inconsistent score: 0(0/35) Model 14 Inconsistent score: 0(0/35) Model 15 Inconsistent score: 0(0/35) Model 16 Inconsistent score: 0(0/35) Model 17 Inconsistent score: 0(0/35) Model 18 Inconsistent score: 0(0/35) Model ave Missing interactions: 0.373 (19/51) weighted: 0.0693 (3.46e+03/4.99e+04) <3: nan (0/0) <3w: nan (0/0) Model 1 Missing interactions: 0.508 (33/65) weighted: 0.333 (3.71e+04/1.11e+05) <3: nan (0/0) <3w: nan (0/0) Model 2 Missing interactions: 0.459 (28/61) weighted: 0.124 (1.08e+04/8.69e+04) <3: nan (0/0) <3w: nan (0/0) Model 3 Missing interactions: 0.421 (24/57) weighted: 0.244 (2.52e+04/1.03e+05) <3: nan (0/0) <3w: nan (0/0) Model 4 Missing interactions: 0.348 (16/46) weighted: 0.0484 (4.35e+03/8.99e+04) <3: nan (0/0) <3w: nan (0/0) Model 5 Missing interactions: 0.456 (26/57) weighted: 0.323 (2.42e+04/7.49e+04) <3: nan (0/0) <3w: nan (0/0) Model 6 Missing interactions: 0.475 (29/61) weighted: 0.154 (1.62e+04/1.06e+05) <3: nan (0/0) <3w: nan (0/0) Model 7 Missing interactions: 0.396 (21/53) weighted: 0.0865 (5.97e+03/6.91e+04) <3: nan (0/0) <3w: nan (0/0) Model 8 Missing interactions: 0.514 (36/70) weighted: 0.273 (2.72e+04/9.96e+04) <3: nan (0/0) <3w: nan (0/0) Model 9 Missing interactions: 0.439 (25/57) weighted: 0.224 (1.99e+04/8.88e+04) <3: nan (0/0) <3w: nan (0/0) Model 10 Missing interactions: 0.492 (32/65) weighted: 0.163 (1.44e+04/8.78e+04) <3: nan (0/0) <3w: nan (0/0) Model 11 Missing interactions: 0.443 (27/61) weighted: 0.105 (9.01e+03/8.55e+04) <3: nan (0/0) <3w: nan (0/0) Model 12 Missing interactions: 0.441 (26/59) weighted: 0.129 (1.15e+04/8.97e+04) <3: nan (0/0) <3w: nan (0/0) Model 13 Missing interactions: 0.431 (25/58) weighted: 0.159 (1.55e+04/9.76e+04) <3: nan (0/0) <3w: nan (0/0) Model 14 Missing interactions: 0.37 (17/46) weighted: 0.0439 (4.16e+03/9.47e+04) <3: nan (0/0) <3w: nan (0/0) Model 15 Missing interactions: 0.404 (21/52) weighted: 0.129 (1.24e+04/9.58e+04) <3: nan (0/0) <3w: nan (0/0) Model 16 Missing interactions: 0.424 (25/59) weighted: 0.227 (2.36e+04/1.04e+05) <3: nan (0/0) <3w: nan (0/0) Model 17 Missing interactions: 0.507 (34/67) weighted: 0.346 (2.91e+04/8.41e+04) <3: nan (0/0) <3w: nan (0/0) Model 18 Missing interactions: 0.485 (32/66) weighted: 0.176 (1.51e+04/8.55e+04) <3: nan (0/0) <3w: nan (0/0) Model ave Recall: 1 Precision: all: 0.627 allw: 0.931 <3: nan <3w: nan F-measure:(Recall,Precision) 0.771 F-measure:(Recall,PrecisionW) 0.964 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 1 Recall: 0.971 Precision: all: 0.492 allw: 0.667 <3: nan <3w: nan F-measure:(Recall,Precision) 0.653 F-measure:(Recall,PrecisionW) 0.791 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 2 Recall: 1 Precision: all: 0.541 allw: 0.876 <3: nan <3w: nan F-measure:(Recall,Precision) 0.702 F-measure:(Recall,PrecisionW) 0.934 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 3 Recall: 1 Precision: all: 0.579 allw: 0.756 <3: nan <3w: nan F-measure:(Recall,Precision) 0.733 F-measure:(Recall,PrecisionW) 0.861 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 4 Recall: 1 Precision: all: 0.652 allw: 0.952 <3: nan <3w: nan F-measure:(Recall,Precision) 0.789 F-measure:(Recall,PrecisionW) 0.975 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 5 Recall: 0.971 Precision: all: 0.544 allw: 0.677 <3: nan <3w: nan F-measure:(Recall,Precision) 0.697 F-measure:(Recall,PrecisionW) 0.798 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 6 Recall: 1 Precision: all: 0.525 allw: 0.846 <3: nan <3w: nan F-measure:(Recall,Precision) 0.688 F-measure:(Recall,PrecisionW) 0.917 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 7 Recall: 0.971 Precision: all: 0.604 allw: 0.914 <3: nan <3w: nan F-measure:(Recall,Precision) 0.745 F-measure:(Recall,PrecisionW) 0.942 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 8 Recall: 1 Precision: all: 0.486 allw: 0.727 <3: nan <3w: nan F-measure:(Recall,Precision) 0.654 F-measure:(Recall,PrecisionW) 0.842 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 9 Recall: 0.971 Precision: all: 0.561 allw: 0.776 <3: nan <3w: nan F-measure:(Recall,Precision) 0.712 F-measure:(Recall,PrecisionW) 0.863 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 10 Recall: 1 Precision: all: 0.508 allw: 0.837 <3: nan <3w: nan F-measure:(Recall,Precision) 0.673 F-measure:(Recall,PrecisionW) 0.911 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 11 Recall: 1 Precision: all: 0.557 allw: 0.895 <3: nan <3w: nan F-measure:(Recall,Precision) 0.716 F-measure:(Recall,PrecisionW) 0.944 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 12 Recall: 1 Precision: all: 0.559 allw: 0.871 <3: nan <3w: nan F-measure:(Recall,Precision) 0.717 F-measure:(Recall,PrecisionW) 0.931 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 13 Recall: 1 Precision: all: 0.569 allw: 0.841 <3: nan <3w: nan F-measure:(Recall,Precision) 0.725 F-measure:(Recall,PrecisionW) 0.914 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 14 Recall: 1 Precision: all: 0.63 allw: 0.956 <3: nan <3w: nan F-measure:(Recall,Precision) 0.773 F-measure:(Recall,PrecisionW) 0.978 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 15 Recall: 1 Precision: all: 0.596 allw: 0.871 <3: nan <3w: nan F-measure:(Recall,Precision) 0.747 F-measure:(Recall,PrecisionW) 0.931 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 16 Recall: 1 Precision: all: 0.576 allw: 0.773 <3: nan <3w: nan F-measure:(Recall,Precision) 0.731 F-measure:(Recall,PrecisionW) 0.872 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 17 Recall: 1 Precision: all: 0.493 allw: 0.654 <3: nan <3w: nan F-measure:(Recall,Precision) 0.66 F-measure:(Recall,PrecisionW) 0.791 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan Model 18 Recall: 1 Precision: all: 0.515 allw: 0.824 <3: nan <3w: nan F-measure:(Recall,Precision) 0.68 F-measure:(Recall,PrecisionW) 0.903 F-measure:(0,PrecisionIdeal) nan F-measure:(0,PrecisionIdealW) nan For freely-rotating-chain model: Model ave Inconsistent score: 0.486(17/35) Model ave Missing interactions: 0.273 (3/11) weighted: 0.144 (227/1.58e+03) <3: nan (0/0) <3w: nan (0/0) Recall: 0.514 Precision: all: 0.727 allw: 0.856 F-measure:(RecallFree,PrecisionFree) 0.603 F-measure:(ReallFree,PrecisionFreeW) 0.643 # Summary for c_ali.peaks Total simulated peaks: 377 Number of peaks NOT matched in the Peak List: 4 M score = 0.011 Average shift in HX: 0.00093 Average ab-shift in HX: 0.0013(Assignment used: 197) Average shift in X: 0.0041 Average ab-shift in X: 0.009(Assignment used: 148) Average shift in HX2: 8.7e-05 Average ab-shift in HX2: 0.0016(Assignment used: 238) #For peaklist c_ali.peaks: Rmax: 5 Model ave Inconsistent score: 0.00963(19/1974) Model 1 Inconsistent score: 0.00811(16/1974) Model 2 Inconsistent score: 0.00709(14/1974) Model 3 Inconsistent score: 0.00659(13/1974) Model 4 Inconsistent score: 0.00912(18/1974) Model 5 Inconsistent score: 0.00557(11/1974) Model 6 Inconsistent score: 0.00963(19/1974) Model 7 Inconsistent score: 0.00861(17/1974) Model 8 Inconsistent score: 0.00861(17/1974) Model 9 Inconsistent score: 0.00963(19/1974) Model 10 Inconsistent score: 0.0106(21/1974) Model 11 Inconsistent score: 0.00709(14/1974) Model 12 Inconsistent score: 0.0117(23/1974) Model 13 Inconsistent score: 0.0076(15/1974) Model 14 Inconsistent score: 0.0076(15/1974) Model 15 Inconsistent score: 0.0106(21/1974) Model 16 Inconsistent score: 0.0076(15/1974) Model 17 Inconsistent score: 0.00659(13/1974) Model 18 Inconsistent score: 0.0076(15/1974) Model ave Missing interactions: 0.339 (718/2117) weighted: 0.0578 (3.28e+05/5.67e+06) <3: 0.00373 (1/268) <3w: 0.00406 (1.06e+04/2.6e+06) Model 1 Missing interactions: 0.356 (790/2218) weighted: 0.0811 (4.97e+05/6.13e+06) <3: 0.00375 (1/267) <3w: 0.00389 (1.01e+04/2.6e+06) Model 2 Missing interactions: 0.355 (786/2211) weighted: 0.0653 (4.03e+05/6.17e+06) <3: 0.00373 (1/268) <3w: 0.00389 (1.01e+04/2.6e+06) Model 3 Missing interactions: 0.354 (785/2218) weighted: 0.075 (4.63e+05/6.18e+06) <3: 0.00373 (1/268) <3w: 0.0041 (1.07e+04/2.61e+06) Model 4 Missing interactions: 0.35 (784/2237) weighted: 0.0792 (4.91e+05/6.2e+06) <3: 0.00373 (1/268) <3w: 0.00385 (1.01e+04/2.63e+06) Model 5 Missing interactions: 0.353 (784/2219) weighted: 0.0839 (5.22e+05/6.22e+06) <3: 0.00373 (1/268) <3w: 0.00383 (1.01e+04/2.64e+06) Model 6 Missing interactions: 0.357 (799/2238) weighted: 0.0792 (4.85e+05/6.13e+06) <3: 0.0037 (1/270) <3w: 0.0041 (1.07e+04/2.61e+06) Model 7 Missing interactions: 0.353 (778/2203) weighted: 0.0743 (4.58e+05/6.16e+06) <3: 0.00376 (1/266) <3w: 0.00409 (1.07e+04/2.62e+06) Model 8 Missing interactions: 0.358 (804/2244) weighted: 0.0704 (4.32e+05/6.14e+06) <3: 0.00369 (1/271) <3w: 0.0042 (1.1e+04/2.63e+06) Model 9 Missing interactions: 0.353 (789/2232) weighted: 0.0764 (4.74e+05/6.21e+06) <3: 0.00375 (1/267) <3w: 0.00405 (1.07e+04/2.65e+06) Model 10 Missing interactions: 0.352 (770/2186) weighted: 0.0656 (4e+05/6.1e+06) <3: 0.00376 (1/266) <3w: 0.00407 (1.07e+04/2.63e+06) Model 11 Missing interactions: 0.357 (797/2234) weighted: 0.0788 (4.86e+05/6.16e+06) <3: 0.00372 (1/269) <3w: 0.00388 (1.01e+04/2.61e+06) Model 12 Missing interactions: 0.356 (785/2203) weighted: 0.0683 (4.17e+05/6.11e+06) <3: 0.00372 (1/269) <3w: 0.00392 (1.01e+04/2.58e+06) Model 13 Missing interactions: 0.352 (776/2202) weighted: 0.0688 (4.23e+05/6.15e+06) <3: 0.00372 (1/269) <3w: 0.00411 (1.07e+04/2.6e+06) Model 14 Missing interactions: 0.346 (765/2214) weighted: 0.0899 (5.53e+05/6.15e+06) <3: 0.00373 (1/268) <3w: 0.00408 (1.07e+04/2.63e+06) Model 15 Missing interactions: 0.351 (765/2182) weighted: 0.0777 (4.72e+05/6.07e+06) <3: 0.00373 (1/268) <3w: 0.0041 (1.07e+04/2.61e+06) Model 16 Missing interactions: 0.351 (768/2189) weighted: 0.0732 (4.51e+05/6.17e+06) <3: 0.00373 (1/268) <3w: 0.00392 (1.01e+04/2.58e+06) Model 17 Missing interactions: 0.357 (795/2230) weighted: 0.0847 (5.27e+05/6.22e+06) <3: 0.00373 (1/268) <3w: 0.00422 (1.1e+04/2.61e+06) Model 18 Missing interactions: 0.361 (805/2228) weighted: 0.0814 (4.98e+05/6.13e+06) <3: 0.00373 (1/268) <3w: 0.0039 (1.01e+04/2.59e+06) Model ave Recall: 0.99 Precision: all: 0.661 allw: 0.942 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.793 F-measure:(Recall,PrecisionW) 0.966 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 1 Recall: 0.992 Precision: all: 0.644 allw: 0.919 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.781 F-measure:(Recall,PrecisionW) 0.954 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 2 Recall: 0.993 Precision: all: 0.645 allw: 0.935 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.782 F-measure:(Recall,PrecisionW) 0.963 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 3 Recall: 0.993 Precision: all: 0.646 allw: 0.925 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.783 F-measure:(Recall,PrecisionW) 0.958 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 4 Recall: 0.991 Precision: all: 0.65 allw: 0.921 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.785 F-measure:(Recall,PrecisionW) 0.955 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 5 Recall: 0.994 Precision: all: 0.647 allw: 0.916 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.784 F-measure:(Recall,PrecisionW) 0.954 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 6 Recall: 0.99 Precision: all: 0.643 allw: 0.921 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.78 F-measure:(Recall,PrecisionW) 0.954 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 7 Recall: 0.991 Precision: all: 0.647 allw: 0.926 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.783 F-measure:(Recall,PrecisionW) 0.957 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 8 Recall: 0.991 Precision: all: 0.642 allw: 0.93 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.779 F-measure:(Recall,PrecisionW) 0.959 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 9 Recall: 0.99 Precision: all: 0.647 allw: 0.924 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.782 F-measure:(Recall,PrecisionW) 0.956 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 10 Recall: 0.989 Precision: all: 0.648 allw: 0.934 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.783 F-measure:(Recall,PrecisionW) 0.961 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 11 Recall: 0.993 Precision: all: 0.643 allw: 0.921 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.781 F-measure:(Recall,PrecisionW) 0.956 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 12 Recall: 0.988 Precision: all: 0.644 allw: 0.932 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.78 F-measure:(Recall,PrecisionW) 0.959 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 13 Recall: 0.992 Precision: all: 0.648 allw: 0.931 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.784 F-measure:(Recall,PrecisionW) 0.961 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 14 Recall: 0.992 Precision: all: 0.654 allw: 0.91 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.789 F-measure:(Recall,PrecisionW) 0.949 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 15 Recall: 0.989 Precision: all: 0.649 allw: 0.922 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.784 F-measure:(Recall,PrecisionW) 0.955 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 16 Recall: 0.992 Precision: all: 0.649 allw: 0.927 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.785 F-measure:(Recall,PrecisionW) 0.959 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 17 Recall: 0.993 Precision: all: 0.643 allw: 0.915 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.781 F-measure:(Recall,PrecisionW) 0.953 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 Model 18 Recall: 0.992 Precision: all: 0.639 allw: 0.919 <3: 0.996 <3w: 0.996 F-measure:(Recall,Precision) 0.777 F-measure:(Recall,PrecisionW) 0.954 F-measure:(0,PrecisionIdeal) 0.998 F-measure:(0,PrecisionIdealW) 0.998 For freely-rotating-chain model: Model ave Inconsistent score: 0.266(526/1974) Model ave Missing interactions: 0.215 (192/895) weighted: 0.0521 (3.26e+04/6.24e+05) <3: 0.00379 (1/264) <3w: 0.00217 (929/4.28e+05) Recall: 0.734 Precision: all: 0.785 allw: 0.948 F-measure:(RecallFree,PrecisionFree) 0.759 F-measure:(ReallFree,PrecisionFreeW) 0.827 Final M-score 0.0105 4/381 Model ave Final Recall-score for input query structures: 0.991 Final Precision-score for input query structures: 0.942 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.966 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.815 Model 1 Final Recall-score for input query structures: 0.992 Final Precision-score for input query structures: 0.914 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.951 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.728 Model 2 Final Recall-score for input query structures: 0.993 Final Precision-score for input query structures: 0.934 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.963 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.798 Model 3 Final Recall-score for input query structures: 0.994 Final Precision-score for input query structures: 0.922 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.957 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.763 Model 4 Final Recall-score for input query structures: 0.991 Final Precision-score for input query structures: 0.921 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.955 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.751 Model 5 Final Recall-score for input query structures: 0.994 Final Precision-score for input query structures: 0.913 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.952 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.734 Model 6 Final Recall-score for input query structures: 0.991 Final Precision-score for input query structures: 0.92 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.954 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.746 Model 7 Final Recall-score for input query structures: 0.991 Final Precision-score for input query structures: 0.926 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.957 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.763 Model 8 Final Recall-score for input query structures: 0.992 Final Precision-score for input query structures: 0.926 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.958 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.769 Model 9 Final Recall-score for input query structures: 0.99 Final Precision-score for input query structures: 0.922 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.955 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.751 Model 10 Final Recall-score for input query structures: 0.99 Final Precision-score for input query structures: 0.933 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.96 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.78 Model 11 Final Recall-score for input query structures: 0.993 Final Precision-score for input query structures: 0.921 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.956 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.757 Model 12 Final Recall-score for input query structures: 0.989 Final Precision-score for input query structures: 0.931 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.959 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.775 Model 13 Final Recall-score for input query structures: 0.993 Final Precision-score for input query structures: 0.93 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.96 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.78 Model 14 Final Recall-score for input query structures: 0.993 Final Precision-score for input query structures: 0.911 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.95 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.723 Model 15 Final Recall-score for input query structures: 0.99 Final Precision-score for input query structures: 0.922 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.954 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.746 Model 16 Final Recall-score for input query structures: 0.993 Final Precision-score for input query structures: 0.924 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.957 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.763 Model 17 Final Recall-score for input query structures: 0.994 Final Precision-score for input query structures: 0.912 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.951 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.728 Model 18 Final Recall-score for input query structures: 0.993 Final Precision-score for input query structures: 0.917 Final Recall-score for ideal true structures: 1 Final Precision-score for ideal true structures: 0.996 Final Recall-score for freely-rotating-chain model: 0.73 Final Precision-score for freely-rotating-chain model: 0.948 Summary: F-score of input query structures: 0.953 F-score of ideal true structures: 0.998 F-score of freely-rotating-chain model: 0.825 DP-Score: 0.74 Statistics: =========== NOESY_Assign: User CPU Time: 18.2 sec. Syst CPU Time: 0.4 sec. Other Processes: User CPU Time: 0.28 sec. Syst CPU Time: 0.02 sec. Total Elapsed Time: 18.9 sec.