##TEST 1: Complex difficulty: medium ##TEST 2: Complex class: enzyme ##CHAINTEST E 1: Interface size: 26 ##CHAINTEST E 2: Number of surface residues: 162 ##CHAINTEST E 3: Interface fraction: 0.160 ##PREDTEST E PIER 1: Number of predictions: 30 ##PREDTEST E PIER 2: Sensitivity: 0.692 ##PREDTEST E PIER 3: Specificity: 0.600 ##PREDTEST E PIER 4: Matthews correlation coeffient: 0.571 ##PREDTEST E PIER 5: P-value of prediction being better than random (hypergeom dist): 1.99e-10 ##PREDTEST E PIER 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E PINUP 1: Number of predictions: 30 ##PREDTEST E PINUP 2: Sensitivity: 0.462 ##PREDTEST E PINUP 3: Specificity: 0.400 ##PREDTEST E PINUP 4: Matthews correlation coeffient: 0.311 ##PREDTEST E PINUP 5: P-value of prediction being better than random (hypergeom dist): 0.000337 ##PREDTEST E PINUP 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E ProMate 1: Number of predictions: 30 ##PREDTEST E ProMate 2: Sensitivity: 0.769 ##PREDTEST E ProMate 3: Specificity: 0.667 ##PREDTEST E ProMate 4: Matthews correlation coeffient: 0.657 ##PREDTEST E ProMate 5: P-value of prediction being better than random (hypergeom dist): 2.41e-13 ##PREDTEST E ProMate 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E SPPIDER 1: Number of predictions: 30 ##PREDTEST E SPPIDER 2: Sensitivity: 0.192 ##PREDTEST E SPPIDER 3: Specificity: 0.167 ##PREDTEST E SPPIDER 4: Matthews correlation coeffient: 0.008 ##PREDTEST E SPPIDER 5: P-value of prediction being better than random (hypergeom dist): 0.553 ##PREDTEST E SPPIDER 6: P-value of prediction being worse than random (hypergeom dist): 0.659 ##PREDTEST E WHISCY 1: Number of predictions: 30 ##PREDTEST E WHISCY 2: Sensitivity: 0.538 ##PREDTEST E WHISCY 3: Specificity: 0.467 ##PREDTEST E WHISCY 4: Matthews correlation coeffient: 0.398 ##PREDTEST E WHISCY 5: P-value of prediction being better than random (hypergeom dist): 6.79e-06 ##PREDTEST E WHISCY 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E cons-PPISP 1: Number of predictions: 30 ##PREDTEST E cons-PPISP 2: Sensitivity: 0.538 ##PREDTEST E cons-PPISP 3: Specificity: 0.467 ##PREDTEST E cons-PPISP 4: Matthews correlation coeffient: 0.398 ##PREDTEST E cons-PPISP 5: P-value of prediction being better than random (hypergeom dist): 6.79e-06 ##PREDTEST E cons-PPISP 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E cport 1: Number of predictions: 37 ##PREDTEST E cport 2: Sensitivity: 0.769 ##PREDTEST E cport 3: Specificity: 0.541 ##PREDTEST E cport 4: Matthews correlation coeffient: 0.563 ##PREDTEST E cport 5: P-value of prediction being better than random (hypergeom dist): 9.33e-11 ##PREDTEST E cport 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E cport-cutoff1 1: Number of predictions: 18 ##PREDTEST E cport-cutoff1 2: Sensitivity: 0.423 ##PREDTEST E cport-cutoff1 3: Specificity: 0.611 ##PREDTEST E cport-cutoff1 4: Matthews correlation coeffient: 0.434 ##PREDTEST E cport-cutoff1 5: P-value of prediction being better than random (hypergeom dist): 3.49e-06 ##PREDTEST E cport-cutoff1 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E cport-cutoff2 1: Number of predictions: 26 ##PREDTEST E cport-cutoff2 2: Sensitivity: 0.577 ##PREDTEST E cport-cutoff2 3: Specificity: 0.577 ##PREDTEST E cport-cutoff2 4: Matthews correlation coeffient: 0.496 ##PREDTEST E cport-cutoff2 5: P-value of prediction being better than random (hypergeom dist): 4.8e-08 ##PREDTEST E cport-cutoff2 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E dockpred-run1-it0 1: Number of predictions: 37 ##PREDTEST E dockpred-run1-it0 2: Sensitivity: 0.615 ##PREDTEST E dockpred-run1-it0 3: Specificity: 0.432 ##PREDTEST E dockpred-run1-it0 4: Matthews correlation coeffient: 0.403 ##PREDTEST E dockpred-run1-it0 5: P-value of prediction being better than random (hypergeom dist): 3.06e-06 ##PREDTEST E dockpred-run1-it0 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E dockpred-run1-it0-allstructures 1: Number of predictions: 37 ##PREDTEST E dockpred-run1-it0-allstructures 2: Sensitivity: 0.462 ##PREDTEST E dockpred-run1-it0-allstructures 3: Specificity: 0.324 ##PREDTEST E dockpred-run1-it0-allstructures 4: Matthews correlation coeffient: 0.243 ##PREDTEST E dockpred-run1-it0-allstructures 5: P-value of prediction being better than random (hypergeom dist): 0.00353 ##PREDTEST E dockpred-run1-it0-allstructures 6: P-value of prediction being worse than random (hypergeom dist): 0.999 ##PREDTEST E dockpred-run1-it0-filtered 1: Number of predictions: 37 ##PREDTEST E dockpred-run1-it0-filtered 2: Sensitivity: 0.615 ##PREDTEST E dockpred-run1-it0-filtered 3: Specificity: 0.432 ##PREDTEST E dockpred-run1-it0-filtered 4: Matthews correlation coeffient: 0.403 ##PREDTEST E dockpred-run1-it0-filtered 5: P-value of prediction being better than random (hypergeom dist): 3.06e-06 ##PREDTEST E dockpred-run1-it0-filtered 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E dockpred-run1-it0-smooth 1: Number of predictions: 37 ##PREDTEST E dockpred-run1-it0-smooth 2: Sensitivity: 0.615 ##PREDTEST E dockpred-run1-it0-smooth 3: Specificity: 0.432 ##PREDTEST E dockpred-run1-it0-smooth 4: Matthews correlation coeffient: 0.403 ##PREDTEST E dockpred-run1-it0-smooth 5: P-value of prediction being better than random (hypergeom dist): 3.06e-06 ##PREDTEST E dockpred-run1-it0-smooth 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E dockpred-run1-it1 1: Number of predictions: 37 ##PREDTEST E dockpred-run1-it1 2: Sensitivity: 0.615 ##PREDTEST E dockpred-run1-it1 3: Specificity: 0.432 ##PREDTEST E dockpred-run1-it1 4: Matthews correlation coeffient: 0.403 ##PREDTEST E dockpred-run1-it1 5: P-value of prediction being better than random (hypergeom dist): 3.06e-06 ##PREDTEST E dockpred-run1-it1 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E dockpred-run1-water 1: Number of predictions: 37 ##PREDTEST E dockpred-run1-water 2: Sensitivity: 0.615 ##PREDTEST E dockpred-run1-water 3: Specificity: 0.432 ##PREDTEST E dockpred-run1-water 4: Matthews correlation coeffient: 0.403 ##PREDTEST E dockpred-run1-water 5: P-value of prediction being better than random (hypergeom dist): 3.06e-06 ##PREDTEST E dockpred-run1-water 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E dockpred-run3-it0 1: Number of predictions: 37 ##PREDTEST E dockpred-run3-it0 2: Sensitivity: 0.346 ##PREDTEST E dockpred-run3-it0 3: Specificity: 0.243 ##PREDTEST E dockpred-run3-it0 4: Matthews correlation coeffient: 0.123 ##PREDTEST E dockpred-run3-it0 5: P-value of prediction being better than random (hypergeom dist): 0.0985 ##PREDTEST E dockpred-run3-it0 6: P-value of prediction being worse than random (hypergeom dist): 0.961 ##PREDTEST E dockpred-run3-it0-allstructures 1: Number of predictions: 37 ##PREDTEST E dockpred-run3-it0-allstructures 2: Sensitivity: 0.077 ##PREDTEST E dockpred-run3-it0-allstructures 3: Specificity: 0.054 ##PREDTEST E dockpred-run3-it0-allstructures 4: Matthews correlation coeffient: -0.158 ##PREDTEST E dockpred-run3-it0-allstructures 5: P-value of prediction being better than random (hypergeom dist): 0.994 ##PREDTEST E dockpred-run3-it0-allstructures 6: P-value of prediction being worse than random (hypergeom dist): 0.0321 ##PREDTEST E dockpred-run3-it0-filtered 1: Number of predictions: 37 ##PREDTEST E dockpred-run3-it0-filtered 2: Sensitivity: 0.346 ##PREDTEST E dockpred-run3-it0-filtered 3: Specificity: 0.243 ##PREDTEST E dockpred-run3-it0-filtered 4: Matthews correlation coeffient: 0.123 ##PREDTEST E dockpred-run3-it0-filtered 5: P-value of prediction being better than random (hypergeom dist): 0.0985 ##PREDTEST E dockpred-run3-it0-filtered 6: P-value of prediction being worse than random (hypergeom dist): 0.961 ##PREDTEST E dockpred-run3-it1 1: Number of predictions: 37 ##PREDTEST E dockpred-run3-it1 2: Sensitivity: 0.346 ##PREDTEST E dockpred-run3-it1 3: Specificity: 0.243 ##PREDTEST E dockpred-run3-it1 4: Matthews correlation coeffient: 0.123 ##PREDTEST E dockpred-run3-it1 5: P-value of prediction being better than random (hypergeom dist): 0.0985 ##PREDTEST E dockpred-run3-it1 6: P-value of prediction being worse than random (hypergeom dist): 0.961 ##PREDTEST E dockpred-run3-water 1: Number of predictions: 37 ##PREDTEST E dockpred-run3-water 2: Sensitivity: 0.385 ##PREDTEST E dockpred-run3-water 3: Specificity: 0.270 ##PREDTEST E dockpred-run3-water 4: Matthews correlation coeffient: 0.163 ##PREDTEST E dockpred-run3-water 5: P-value of prediction being better than random (hypergeom dist): 0.0389 ##PREDTEST E dockpred-run3-water 6: P-value of prediction being worse than random (hypergeom dist): 0.987 ##PREDTEST E pinup22 1: Number of predictions: 22 ##PREDTEST E pinup22 2: Sensitivity: 0.385 ##PREDTEST E pinup22 3: Specificity: 0.455 ##PREDTEST E pinup22 4: Matthews correlation coeffient: 0.318 ##PREDTEST E pinup22 5: P-value of prediction being better than random (hypergeom dist): 0.000383 ##PREDTEST E pinup22 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E pinup33 1: Number of predictions: 33 ##PREDTEST E pinup33 2: Sensitivity: 0.462 ##PREDTEST E pinup33 3: Specificity: 0.364 ##PREDTEST E pinup33 4: Matthews correlation coeffient: 0.280 ##PREDTEST E pinup33 5: P-value of prediction being better than random (hypergeom dist): 0.00102 ##PREDTEST E pinup33 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST E pinup50 1: Number of predictions: 50 ##PREDTEST E pinup50 2: Sensitivity: 0.654 ##PREDTEST E pinup50 3: Specificity: 0.340 ##PREDTEST E pinup50 4: Matthews correlation coeffient: 0.327 ##PREDTEST E pinup50 5: P-value of prediction being better than random (hypergeom dist): 7.67e-05 ##PREDTEST E pinup50 6: P-value of prediction being worse than random (hypergeom dist): 1 ##CHAINTEST I 1: Interface size: 15 ##CHAINTEST I 2: Number of surface residues: 61 ##CHAINTEST I 3: Interface fraction: 0.246 ##PREDTEST I PIER 1: Number of predictions: 30 ##PREDTEST I PIER 2: Sensitivity: 1.000 ##PREDTEST I PIER 3: Specificity: 0.500 ##PREDTEST I PIER 4: Matthews correlation coeffient: 0.580 ##PREDTEST I PIER 5: P-value of prediction being better than random (hypergeom dist): 2.2e-06 ##PREDTEST I PIER 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST I PINUP 1: Number of predictions: 30 ##PREDTEST I PINUP 2: Sensitivity: 1.000 ##PREDTEST I PINUP 3: Specificity: 0.500 ##PREDTEST I PINUP 4: Matthews correlation coeffient: 0.580 ##PREDTEST I PINUP 5: P-value of prediction being better than random (hypergeom dist): 2.2e-06 ##PREDTEST I PINUP 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST I ProMate 1: Number of predictions: 30 ##PREDTEST I ProMate 2: Sensitivity: 0.600 ##PREDTEST I ProMate 3: Specificity: 0.300 ##PREDTEST I ProMate 4: Matthews correlation coeffient: 0.124 ##PREDTEST I ProMate 5: P-value of prediction being better than random (hypergeom dist): 0.252 ##PREDTEST I ProMate 6: P-value of prediction being worse than random (hypergeom dist): 0.897 ##PREDTEST I SPPIDER 1: Number of predictions: 30 ##PREDTEST I SPPIDER 2: Sensitivity: 0.867 ##PREDTEST I SPPIDER 3: Specificity: 0.433 ##PREDTEST I SPPIDER 4: Matthews correlation coeffient: 0.428 ##PREDTEST I SPPIDER 5: P-value of prediction being better than random (hypergeom dist): 0.000856 ##PREDTEST I SPPIDER 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST I WHISCY 1: Number of predictions: 30 ##PREDTEST I WHISCY 2: Sensitivity: 0.933 ##PREDTEST I WHISCY 3: Specificity: 0.467 ##PREDTEST I WHISCY 4: Matthews correlation coeffient: 0.504 ##PREDTEST I WHISCY 5: P-value of prediction being better than random (hypergeom dist): 6.61e-05 ##PREDTEST I WHISCY 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST I cons-PPISP 1: Number of predictions: 30 ##PREDTEST I cons-PPISP 2: Sensitivity: 0.800 ##PREDTEST I cons-PPISP 3: Specificity: 0.400 ##PREDTEST I cons-PPISP 4: Matthews correlation coeffient: 0.352 ##PREDTEST I cons-PPISP 5: P-value of prediction being better than random (hypergeom dist): 0.00637 ##PREDTEST I cons-PPISP 6: P-value of prediction being worse than random (hypergeom dist): 0.999 ##PREDTEST I cport 1: Number of predictions: 42 ##PREDTEST I cport 2: Sensitivity: 1.000 ##PREDTEST I cport 3: Specificity: 0.357 ##PREDTEST I cport 4: Matthews correlation coeffient: 0.384 ##PREDTEST I cport 5: P-value of prediction being better than random (hypergeom dist): 0.0014 ##PREDTEST I cport 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST I cport-cutoff1 1: Number of predictions: 27 ##PREDTEST I cport-cutoff1 2: Sensitivity: 0.867 ##PREDTEST I cport-cutoff1 3: Specificity: 0.481 ##PREDTEST I cport-cutoff1 4: Matthews correlation coeffient: 0.488 ##PREDTEST I cport-cutoff1 5: P-value of prediction being better than random (hypergeom dist): 0.000169 ##PREDTEST I cport-cutoff1 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST I cport-cutoff2 1: Number of predictions: 34 ##PREDTEST I cport-cutoff2 2: Sensitivity: 0.933 ##PREDTEST I cport-cutoff2 3: Specificity: 0.412 ##PREDTEST I cport-cutoff2 4: Matthews correlation coeffient: 0.432 ##PREDTEST I cport-cutoff2 5: P-value of prediction being better than random (hypergeom dist): 0.000559 ##PREDTEST I cport-cutoff2 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST I dockpred-run1-it0 1: Number of predictions: 42 ##PREDTEST I dockpred-run1-it0 2: Sensitivity: 0.933 ##PREDTEST I dockpred-run1-it0 3: Specificity: 0.333 ##PREDTEST I dockpred-run1-it0 4: Matthews correlation coeffient: 0.302 ##PREDTEST I dockpred-run1-it0 5: P-value of prediction being better than random (hypergeom dist): 0.0156 ##PREDTEST I dockpred-run1-it0 6: P-value of prediction being worse than random (hypergeom dist): 0.999 ##PREDTEST I dockpred-run1-it0-allstructures 1: Number of predictions: 42 ##PREDTEST I dockpred-run1-it0-allstructures 2: Sensitivity: 0.933 ##PREDTEST I dockpred-run1-it0-allstructures 3: Specificity: 0.333 ##PREDTEST I dockpred-run1-it0-allstructures 4: Matthews correlation coeffient: 0.302 ##PREDTEST I dockpred-run1-it0-allstructures 5: P-value of prediction being better than random (hypergeom dist): 0.0156 ##PREDTEST I dockpred-run1-it0-allstructures 6: P-value of prediction being worse than random (hypergeom dist): 0.999 ##PREDTEST I dockpred-run1-it0-filtered 1: Number of predictions: 42 ##PREDTEST I dockpred-run1-it0-filtered 2: Sensitivity: 0.933 ##PREDTEST I dockpred-run1-it0-filtered 3: Specificity: 0.333 ##PREDTEST I dockpred-run1-it0-filtered 4: Matthews correlation coeffient: 0.302 ##PREDTEST I dockpred-run1-it0-filtered 5: P-value of prediction being better than random (hypergeom dist): 0.0156 ##PREDTEST I dockpred-run1-it0-filtered 6: P-value of prediction being worse than random (hypergeom dist): 0.999 ##PREDTEST I dockpred-run1-it0-smooth 1: Number of predictions: 42 ##PREDTEST I dockpred-run1-it0-smooth 2: Sensitivity: 0.733 ##PREDTEST I dockpred-run1-it0-smooth 3: Specificity: 0.262 ##PREDTEST I dockpred-run1-it0-smooth 4: Matthews correlation coeffient: 0.055 ##PREDTEST I dockpred-run1-it0-smooth 5: P-value of prediction being better than random (hypergeom dist): 0.465 ##PREDTEST I dockpred-run1-it0-smooth 6: P-value of prediction being worse than random (hypergeom dist): 0.771 ##PREDTEST I dockpred-run1-it1 1: Number of predictions: 42 ##PREDTEST I dockpred-run1-it1 2: Sensitivity: 0.933 ##PREDTEST I dockpred-run1-it1 3: Specificity: 0.333 ##PREDTEST I dockpred-run1-it1 4: Matthews correlation coeffient: 0.302 ##PREDTEST I dockpred-run1-it1 5: P-value of prediction being better than random (hypergeom dist): 0.0156 ##PREDTEST I dockpred-run1-it1 6: P-value of prediction being worse than random (hypergeom dist): 0.999 ##PREDTEST I dockpred-run1-water 1: Number of predictions: 42 ##PREDTEST I dockpred-run1-water 2: Sensitivity: 0.933 ##PREDTEST I dockpred-run1-water 3: Specificity: 0.333 ##PREDTEST I dockpred-run1-water 4: Matthews correlation coeffient: 0.302 ##PREDTEST I dockpred-run1-water 5: P-value of prediction being better than random (hypergeom dist): 0.0156 ##PREDTEST I dockpred-run1-water 6: P-value of prediction being worse than random (hypergeom dist): 0.999 ##PREDTEST I dockpred-run3-it0 1: Number of predictions: 42 ##PREDTEST I dockpred-run3-it0 2: Sensitivity: 0.800 ##PREDTEST I dockpred-run3-it0 3: Specificity: 0.286 ##PREDTEST I dockpred-run3-it0 4: Matthews correlation coeffient: 0.137 ##PREDTEST I dockpred-run3-it0 5: P-value of prediction being better than random (hypergeom dist): 0.229 ##PREDTEST I dockpred-run3-it0 6: P-value of prediction being worse than random (hypergeom dist): 0.923 ##PREDTEST I dockpred-run3-it0-allstructures 1: Number of predictions: 42 ##PREDTEST I dockpred-run3-it0-allstructures 2: Sensitivity: 0.800 ##PREDTEST I dockpred-run3-it0-allstructures 3: Specificity: 0.286 ##PREDTEST I dockpred-run3-it0-allstructures 4: Matthews correlation coeffient: 0.137 ##PREDTEST I dockpred-run3-it0-allstructures 5: P-value of prediction being better than random (hypergeom dist): 0.229 ##PREDTEST I dockpred-run3-it0-allstructures 6: P-value of prediction being worse than random (hypergeom dist): 0.923 ##PREDTEST I dockpred-run3-it0-filtered 1: Number of predictions: 42 ##PREDTEST I dockpred-run3-it0-filtered 2: Sensitivity: 0.867 ##PREDTEST I dockpred-run3-it0-filtered 3: Specificity: 0.310 ##PREDTEST I dockpred-run3-it0-filtered 4: Matthews correlation coeffient: 0.220 ##PREDTEST I dockpred-run3-it0-filtered 5: P-value of prediction being better than random (hypergeom dist): 0.0775 ##PREDTEST I dockpred-run3-it0-filtered 6: P-value of prediction being worse than random (hypergeom dist): 0.984 ##PREDTEST I dockpred-run3-it1 1: Number of predictions: 42 ##PREDTEST I dockpred-run3-it1 2: Sensitivity: 0.867 ##PREDTEST I dockpred-run3-it1 3: Specificity: 0.310 ##PREDTEST I dockpred-run3-it1 4: Matthews correlation coeffient: 0.220 ##PREDTEST I dockpred-run3-it1 5: P-value of prediction being better than random (hypergeom dist): 0.0775 ##PREDTEST I dockpred-run3-it1 6: P-value of prediction being worse than random (hypergeom dist): 0.984 ##PREDTEST I dockpred-run3-water 1: Number of predictions: 42 ##PREDTEST I dockpred-run3-water 2: Sensitivity: 0.867 ##PREDTEST I dockpred-run3-water 3: Specificity: 0.310 ##PREDTEST I dockpred-run3-water 4: Matthews correlation coeffient: 0.220 ##PREDTEST I dockpred-run3-water 5: P-value of prediction being better than random (hypergeom dist): 0.0775 ##PREDTEST I dockpred-run3-water 6: P-value of prediction being worse than random (hypergeom dist): 0.984 ##PREDTEST I pinup22 1: Number of predictions: 22 ##PREDTEST I pinup22 2: Sensitivity: 0.933 ##PREDTEST I pinup22 3: Specificity: 0.636 ##PREDTEST I pinup22 4: Matthews correlation coeffient: 0.681 ##PREDTEST I pinup22 5: P-value of prediction being better than random (hypergeom dist): 1.79e-07 ##PREDTEST I pinup22 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST I pinup33 1: Number of predictions: 33 ##PREDTEST I pinup33 2: Sensitivity: 1.000 ##PREDTEST I pinup33 3: Specificity: 0.455 ##PREDTEST I pinup33 4: Matthews correlation coeffient: 0.526 ##PREDTEST I pinup33 5: P-value of prediction being better than random (hypergeom dist): 1.47e-05 ##PREDTEST I pinup33 6: P-value of prediction being worse than random (hypergeom dist): 1 ##PREDTEST I pinup50 1: Number of predictions: 50 ##PREDTEST I pinup50 2: Sensitivity: 1.000 ##PREDTEST I pinup50 3: Specificity: 0.300 ##PREDTEST I pinup50 4: Matthews correlation coeffient: 0.268 ##PREDTEST I pinup50 5: P-value of prediction being better than random (hypergeom dist): 0.0319 ##PREDTEST I pinup50 6: P-value of prediction being worse than random (hypergeom dist): 1 ##RUNTEST run1 1: Number of structures in it0: 10000 ##RUNTEST run1 2: Number of * (no fnat) generated in it0: 151 ##RUNTEST run1 3: Number of ** (no fnat) generated in it0: 15 ##RUNTEST run1 4: Number of *** (no fnat) generated in it0: 0 ##RUNTEST run1 5: Number of * (no fnat) generated in it0 top 400: 17 ##RUNTEST run1 6: Number of ** (no fnat) generated in it0 top 400: 3 ##RUNTEST run1 7: Number of *** (no fnat) generated in it0 top 400: 0 ##RUNTEST run1 8: Enrichment factor for * (no fnat) in top 400: 2.815 ##RUNTEST run1 9: P-value of enrichment factor for * (no fnat) being better than random (hypergeom dist): 0.000108 ##RUNTEST run1 10: P-value of enrichment factor for * (no fnat) being worse than random (hypergeom dist): 1 ##RUNTEST run1 11: Enrichment factor for ** (no fnat) in top 400: 5.000 ##RUNTEST run1 12: P-value of enrichment factor for ** (no fnat) being better than random (hypergeom dist): 0.0202 ##RUNTEST run1 13: P-value of enrichment factor for ** (no fnat) being worse than random (hypergeom dist): 0.998 ##RUNTEST run1 17: Number of * (no fnat) in it1: 16 ##RUNTEST run1 18: Number of ** (no fnat) in it1: 4 ##RUNTEST run1 19: Number of *** (no fnat) in it1: 0 ##RUNTEST run1 20: Number of * (no fnat) in water: 16 ##RUNTEST run1 21: Number of ** (no fnat) in water: 4 ##RUNTEST run1 22: Number of *** (no fnat) in water: 0 ##RUNTEST run1 23: Rank of first * (no fnat) in it0: 126 ##RUNTEST run1 24: Rank of first ** (no fnat) in it0: 172 ##RUNTEST run1 25: Rank of first *** (no fnat) in it0: - ##RUNTEST run1 26: Rank of first * (no fnat) in it1: 58 ##RUNTEST run1 27: Rank of first ** (no fnat) in it1: 90 ##RUNTEST run1 28: Rank of first *** (no fnat) in it1: - ##RUNTEST run1 29: Rank of first * (no fnat) in water: 29 ##RUNTEST run1 30: Rank of first ** (no fnat) in water: 58 ##RUNTEST run1 31: Rank of first *** (no fnat) in water: - ##RUNTEST run1 32: Rank of first * (with fnat) in water: 29 ##RUNTEST run1 33: Rank of first ** (with fnat) in water: - ##RUNTEST run1 34: Rank of first *** (with fnat) in water: - ##RUNTEST run1 35: Number of clusters: 21 ##RUNTEST run1 36: Number of clusters with * (with fnat) in the top 4: 1 ##RUNTEST run1 37: Number of clusters with ** (with fnat) in the top 4: 0 ##RUNTEST run1 38: Number of clusters with *** (with fnat) in the top 4: 0 ##RUNTEST run1 39: Rank of the first cluster with * (with fnat): 6 ##RUNTEST run1 40: Rank of the first cluster with ** (with fnat): - ##RUNTEST run1 41: Rank of the first cluster with *** (with fnat): - ##RUNTEST run1 42: Z-rank comparison: number of structures with i-RMSD < 2.5 generated: 0 ##RUNTEST run1 43: Z-rank comparison: number of structures with i-RMSD < 2.5 in water: 0 ##RUNTEST run1 44: Z-rank comparison: number of structures with i-RMSD < 2.5 in water top 100: 0 ##RUNTEST run1 45: Z-rank comparison: number of structures with i-RMSD < 4 generated: 85 ##RUNTEST run1 46: Z-rank comparison: number of structures with i-RMSD < 4 in water: 16 ##RUNTEST run1 47: Z-rank comparison: number of structures with i-RMSD < 4 in water top 100: 2 ##RUNTEST run1 48: Number of * (with fnat) in water: 15 ##RUNTEST run1 49: Number of ** (with fnat) in water: 0 ##RUNTEST run1 50: Number of *** (with fnat) in water: 0 ##RUNTEST run2 1: Number of structures in it0: 5000 ##RUNTEST run2 2: Number of * (no fnat) generated in it0: 129 ##RUNTEST run2 3: Number of ** (no fnat) generated in it0: 25 ##RUNTEST run2 4: Number of *** (no fnat) generated in it0: 0 ##RUNTEST run2 5: Number of * (no fnat) generated in it0 top 400: 5 ##RUNTEST run2 6: Number of ** (no fnat) generated in it0 top 400: 1 ##RUNTEST run2 7: Number of *** (no fnat) generated in it0 top 400: 0 ##RUNTEST run2 8: Enrichment factor for * (no fnat) in top 400: 0.484 ##RUNTEST run2 9: P-value of enrichment factor for * (no fnat) being better than random (hypergeom dist): 0.981 ##RUNTEST run2 10: P-value of enrichment factor for * (no fnat) being worse than random (hypergeom dist): 0.047 ##RUNTEST run2 11: Enrichment factor for ** (no fnat) in top 400: 0.500 ##RUNTEST run2 12: P-value of enrichment factor for ** (no fnat) being better than random (hypergeom dist): 0.876 ##RUNTEST run2 13: P-value of enrichment factor for ** (no fnat) being worse than random (hypergeom dist): 0.394 ##RUNTEST run2 17: Number of * (no fnat) in it1: 4 ##RUNTEST run2 18: Number of ** (no fnat) in it1: 1 ##RUNTEST run2 19: Number of *** (no fnat) in it1: 0 ##RUNTEST run2 20: Number of * (no fnat) in water: 4 ##RUNTEST run2 21: Number of ** (no fnat) in water: 1 ##RUNTEST run2 22: Number of *** (no fnat) in water: 0 ##RUNTEST run2 23: Rank of first * (no fnat) in it0: 249 ##RUNTEST run2 24: Rank of first ** (no fnat) in it0: 379 ##RUNTEST run2 25: Rank of first *** (no fnat) in it0: - ##RUNTEST run2 26: Rank of first * (no fnat) in it1: 28 ##RUNTEST run2 27: Rank of first ** (no fnat) in it1: 208 ##RUNTEST run2 28: Rank of first *** (no fnat) in it1: - ##RUNTEST run2 29: Rank of first * (no fnat) in water: 4 ##RUNTEST run2 30: Rank of first ** (no fnat) in water: 103 ##RUNTEST run2 31: Rank of first *** (no fnat) in water: - ##RUNTEST run2 32: Rank of first * (with fnat) in water: 4 ##RUNTEST run2 33: Rank of first ** (with fnat) in water: - ##RUNTEST run2 34: Rank of first *** (with fnat) in water: - ##RUNTEST run2 35: Number of clusters: 15 ##RUNTEST run2 36: Number of clusters with * (with fnat) in the top 4: 1 ##RUNTEST run2 37: Number of clusters with ** (with fnat) in the top 4: 0 ##RUNTEST run2 38: Number of clusters with *** (with fnat) in the top 4: 0 ##RUNTEST run2 39: Rank of the first cluster with * (with fnat): 6 ##RUNTEST run2 40: Rank of the first cluster with ** (with fnat): - ##RUNTEST run2 41: Rank of the first cluster with *** (with fnat): - ##RUNTEST run2 42: Z-rank comparison: number of structures with i-RMSD < 2.5 generated: 0 ##RUNTEST run2 43: Z-rank comparison: number of structures with i-RMSD < 2.5 in water: 0 ##RUNTEST run2 44: Z-rank comparison: number of structures with i-RMSD < 2.5 in water top 100: 0 ##RUNTEST run2 45: Z-rank comparison: number of structures with i-RMSD < 4 generated: 103 ##RUNTEST run2 46: Z-rank comparison: number of structures with i-RMSD < 4 in water: 4 ##RUNTEST run2 47: Z-rank comparison: number of structures with i-RMSD < 4 in water top 100: 2 ##RUNTEST run2 48: Number of * (with fnat) in water: 4 ##RUNTEST run2 49: Number of ** (with fnat) in water: 0 ##RUNTEST run2 50: Number of *** (with fnat) in water: 0 ##RUNTEST run3 1: Number of structures in it0: 10000 ##RUNTEST run3 2: Number of * (no fnat) generated in it0: 5 ##RUNTEST run3 3: Number of ** (no fnat) generated in it0: 0 ##RUNTEST run3 4: Number of *** (no fnat) generated in it0: 0 ##RUNTEST run3 5: Number of * (no fnat) generated in it0 top 400: 1 ##RUNTEST run3 6: Number of ** (no fnat) generated in it0 top 400: 0 ##RUNTEST run3 7: Number of *** (no fnat) generated in it0 top 400: 0 ##RUNTEST run3 8: Enrichment factor for * (no fnat) in top 400: 5.000 ##RUNTEST run3 9: P-value of enrichment factor for * (no fnat) being better than random (hypergeom dist): 0.185 ##RUNTEST run3 10: P-value of enrichment factor for * (no fnat) being worse than random (hypergeom dist): 0.985 ##RUNTEST run3 17: Number of * (no fnat) in it1: 0 ##RUNTEST run3 18: Number of ** (no fnat) in it1: 0 ##RUNTEST run3 19: Number of *** (no fnat) in it1: 0 ##RUNTEST run3 20: Number of * (no fnat) in water: 0 ##RUNTEST run3 21: Number of ** (no fnat) in water: 0 ##RUNTEST run3 22: Number of *** (no fnat) in water: 0 ##RUNTEST run3 23: Rank of first * (no fnat) in it0: 379 ##RUNTEST run3 24: Rank of first ** (no fnat) in it0: - ##RUNTEST run3 25: Rank of first *** (no fnat) in it0: - ##RUNTEST run3 26: Rank of first * (no fnat) in it1: - ##RUNTEST run3 27: Rank of first ** (no fnat) in it1: - ##RUNTEST run3 28: Rank of first *** (no fnat) in it1: - ##RUNTEST run3 29: Rank of first * (no fnat) in water: - ##RUNTEST run3 30: Rank of first ** (no fnat) in water: - ##RUNTEST run3 31: Rank of first *** (no fnat) in water: - ##RUNTEST run3 32: Rank of first * (with fnat) in water: - ##RUNTEST run3 33: Rank of first ** (with fnat) in water: - ##RUNTEST run3 34: Rank of first *** (with fnat) in water: - ##RUNTEST run3 35: Number of clusters: 42 ##RUNTEST run3 36: Number of clusters with * (with fnat) in the top 4: 0 ##RUNTEST run3 37: Number of clusters with ** (with fnat) in the top 4: 0 ##RUNTEST run3 38: Number of clusters with *** (with fnat) in the top 4: 0 ##RUNTEST run3 39: Rank of the first cluster with * (with fnat): - ##RUNTEST run3 40: Rank of the first cluster with ** (with fnat): - ##RUNTEST run3 41: Rank of the first cluster with *** (with fnat): - ##RUNTEST run3 42: Z-rank comparison: number of structures with i-RMSD < 2.5 generated: 0 ##RUNTEST run3 43: Z-rank comparison: number of structures with i-RMSD < 2.5 in water: 0 ##RUNTEST run3 44: Z-rank comparison: number of structures with i-RMSD < 2.5 in water top 100: 0 ##RUNTEST run3 45: Z-rank comparison: number of structures with i-RMSD < 4 generated: 3 ##RUNTEST run3 46: Z-rank comparison: number of structures with i-RMSD < 4 in water: 0 ##RUNTEST run3 47: Z-rank comparison: number of structures with i-RMSD < 4 in water top 100: 0 ##RUNTEST run3 48: Number of * (with fnat) in water: 0 ##RUNTEST run3 49: Number of ** (with fnat) in water: 0 ##RUNTEST run3 50: Number of *** (with fnat) in water: 0 ##DOCKTEST 1: run1 l-RMSD shift from it0 to it1: 0.086 +/- 1.036 ##DOCKTEST 2: run1 i-RMSD shift from it0 to it1: 0.019 +/- 0.295 ##DOCKTEST 3: run1 fnat shift from it0 to it1: 0.017 +/- 0.038 ##DOCKTEST 4: run1 l-RMSD shift from it1 to water: -0.141 +/- 0.070 ##DOCKTEST 5: run1 i-RMSD shift from it1 to water: -0.093 +/- 0.042 ##DOCKTEST 6: run1 fnat shift from it1 to water: 0.002 +/- 0.012 ##DOCKTEST 7: run1 l-RMSD shift from it0 to it1, for structures with i-RMSD < 4 in it0: -0.017 +/- 1.327 ##DOCKTEST 8: run1 i-RMSD shift from it0 to it1, for structures with i-RMSD < 4 in it0: 0.034 +/- 0.321 ##DOCKTEST 9: run1 fnat shift from it0 to it1, for structures with i-RMSD < 4 in it0: 0.167 +/- 0.063 ##DOCKTEST 10: run1 l-RMSD shift from it1 to water, for structures with i-RMSD < 4 in it0: -0.057 +/- 0.039 ##DOCKTEST 11: run1 i-RMSD shift from it1 to water, for structures with i-RMSD < 4 in it0: -0.054 +/- 0.028 ##DOCKTEST 12: run1 fnat shift from it1 to water, for structures with i-RMSD < 4 in it0: 0.025 +/- 0.031 ##DOCKTEST 13: P-value that run1 is better than run3 (Fisher exact test): 0.000 ##DOCKTEST 14: P-value that run1 is worse than run3 (Fisher exact test): 1.000