CompaRNA - on-line benchmarks of RNA structure prediction methods
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Table of contents:

  1. Overview

  2. Performance Plots

  3. Performance of ProbKnot - scored higher in this pairwise comparison

  4. Performance of HotKnots - scored lower in this pairwise comparison

  5. Compile and download dataset for ProbKnot & HotKnots [.zip] - may take several seconds...


Overview

Metric ProbKnot HotKnots
MCC 0.459 > 0.453
Average MCC ± 95% Confidence Intervals 0.535 ± 0.084 < 0.555 ± 0.100
Sensitivity 0.440 < 0.445
Positive Predictive Value 0.487 > 0.469
Total TP 518 < 524
Total TN 158442 > 158389
Total FP 562 < 609
Total FP CONTRA 69 < 81
Total FP INCONS 477 < 512
Total FP COMP 16 = 16
Total FN 660 > 654
P-value 6.29366556486e-06

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Performance plots


  1. Comparison of performance of ProbKnot and HotKnots. Positive Predictive Value (PPV) is plotted against sensitivity. Each dot represents a single test of each method. See tables below for raw data (individual counts for ProbKnot and HotKnots).

  2. Average Matthews Correlation Coefficients (MCC) with 95% confidence intervals (CIs) were plotted for different RNA families, for which at least 3 members were present in the benchmarking dataset. 'n' denotes the number of MCCs used to calculate the average and CI. See tables below for raw data (individual counts for ProbKnot and HotKnots).

  3. Comparison of average Matthews Correlation Coefficients (MCCs) for ProbKnot and HotKnots. The whiskers correspond to 95% confidence intervals (CIs). 'n' denotes the number of MCCs used to calculate average MCCs and CIs. See tables below for raw data (individual counts for ProbKnot and HotKnots).

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Performance of ProbKnot - scored higher in this pairwise comparison

1. Total counts & total scores for ProbKnot

Total Base Pair Counts
Total TP 518
Total TN 158442
Total FP 562
Total FP CONTRA 69
Total FP INCONS 477
Total FP COMP 16
Total FN 660
Total Scores
MCC 0.459
Average MCC ± 95% Confidence Intervals 0.535 ± 0.084
Sensitivity 0.440
Positive Predictive Value 0.487
Nr of predictions 53

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2. Individual counts for ProbKnot [ download as .csv ]

RNA Chain Rfam family MCC SENS PPV TP TN FP FP CONTRA FP INCONS FP COMP FN
PDB_00005 0.78 0.79 0.79 11 932 3 0 3 0 3
PDB_00018 - 0.20 0.20 0.22 4 1017 14 2 12 0 16
PDB_00020 - 0.41 0.35 0.50 7 766 7 0 7 0 13
PDB_00041 - 0.70 0.50 1.00 6 624 0 0 0 0 6
PDB_00053 - 1.00 1.00 1.00 11 424 0 0 0 0 0
PDB_00056 - 0.93 0.88 1.00 14 616 0 0 0 0 2
PDB_00123 - -0.01 0.00 0.00 0 4151 35 0 35 0 36
PDB_00124 - -0.02 0.00 0.00 0 488 8 2 6 0 10
PDB_00128 - 0.77 0.71 0.83 10 484 2 0 2 0 4
PDB_00134 - 0.79 0.63 1.00 5 373 0 0 0 0 3
PDB_00138 - 0.72 0.63 0.83 5 372 1 0 1 0 3
PDB_00209 - 0.56 0.45 0.71 5 554 2 0 2 0 6
PDB_00243 - 0.63 0.58 0.70 7 620 3 0 3 0 5
PDB_00352 - 0.86 0.79 0.94 15 1209 1 0 1 0 4
PDB_00370 - 0.09 0.12 0.07 3 15183 41 8 31 2 22
PDB_00447 - 0.27 0.25 0.30 11 7103 26 6 20 0 33
PDB_00571 0.60 0.60 0.60 15 3296 10 6 4 0 10
PDB_00713 - 0.43 0.43 0.45 9 1996 12 0 11 1 12
PDB_00716 -0.01 0.00 0.00 0 2680 22 0 21 1 23
PDB_00804 - 0.28 0.28 0.28 14 15350 38 6 30 2 36
PDB_00828 0.86 0.78 0.95 21 2463 1 0 1 0 6
PDB_00829 0.86 0.75 1.00 18 2260 0 0 0 0 6
PDB_00842 - 1.00 1.00 1.00 8 370 0 0 0 0 0
PDB_00851 - 0.45 0.39 0.53 16 4723 14 0 14 0 25
PDB_00857 - 0.80 0.80 0.80 12 1066 3 0 3 0 3
PDB_00874 - 0.05 0.05 0.08 1 933 12 2 10 0 19
PDB_00886 - -0.01 0.00 0.00 0 4148 38 0 38 0 40
PDB_00918 - 0.67 0.57 0.80 4 320 1 0 1 0 3
PDB_01009 0.54 0.57 0.52 12 2462 12 5 6 1 9
PDB_01020 0.86 0.74 1.00 17 2261 1 0 0 1 6
PDB_01040 - 0.30 0.30 0.32 6 1109 13 0 13 0 14
PDB_01059 - 1.00 1.00 1.00 7 224 0 0 0 0 0
PDB_01070 - 0.33 0.30 0.38 16 12678 27 2 24 1 38
PDB_01073 0.86 0.74 1.00 25 4346 1 0 0 1 9
PDB_01092 0.73 0.63 0.85 33 10114 8 1 5 2 19
PDB_01194 - 0.69 0.60 0.82 9 485 2 0 2 0 6
PDB_01201 - 0.98 0.95 1.00 21 1107 0 0 0 0 1
PDB_01203 - 0.74 0.68 0.81 13 1160 3 2 1 0 6
PDB_01250 - 0.22 0.20 0.25 8 12058 24 4 20 0 33
PDB_01260 - 0.53 0.48 0.60 12 1810 8 1 7 0 13
PDB_01281 - -0.03 0.00 0.00 0 366 12 0 12 0 14
PDB_01299 - 0.74 0.67 0.83 10 891 2 1 1 0 5
PDB_01309 - -0.01 0.00 0.00 0 9118 62 9 53 0 39
RFA_00632 0.40 0.39 0.41 11 4068 16 0 16 0 17
RFA_00636 0.44 0.46 0.43 13 3975 17 0 17 0 15
RFA_00767 0.63 0.56 0.71 10 1877 4 0 4 0 8
RFA_00768 0.44 0.44 0.44 8 1873 11 1 9 1 10
RFA_00769 0.54 0.56 0.53 10 1934 9 4 5 0 8
RFA_00770 0.59 0.56 0.63 10 2000 9 0 6 3 8
RFA_00773 0.55 0.56 0.56 10 1935 8 3 5 0 8
RFA_00779 0.63 0.56 0.71 10 1939 4 3 1 0 8
RFA_00808 0.65 0.56 0.75 9 2004 3 0 3 0 7
RFA_00809 0.35 0.38 0.33 6 2127 12 1 11 0 10

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Performance of HotKnots - scored lower in this pairwise comparison

1. Total counts & total scores for HotKnots

Total Base Pair Counts
Total TP 524
Total TN 158389
Total FP 609
Total FP CONTRA 81
Total FP INCONS 512
Total FP COMP 16
Total FN 654
Total Scores
MCC 0.453
Average MCC ± 95% Confidence Intervals 0.555 ± 0.100
Sensitivity 0.445
Positive Predictive Value 0.469
Nr of predictions 53

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2. Individual counts for HotKnots [ download as .csv ]

RNA Chain Rfam family MCC SENS PPV TP TN FP FP CONTRA FP INCONS FP COMP FN
PDB_00005 0.88 0.79 1.00 11 935 0 0 0 0 3
PDB_00018 - 0.20 0.20 0.22 4 1017 14 2 12 0 16
PDB_00020 - 0.38 0.35 0.44 7 764 9 0 9 0 13
PDB_00041 - 1.00 1.00 1.00 12 618 0 0 0 0 0
PDB_00053 - 1.00 1.00 1.00 11 424 0 0 0 0 0
PDB_00056 - 0.93 0.88 1.00 14 616 0 0 0 0 2
PDB_00123 - -0.01 0.00 0.00 0 4151 35 0 35 0 36
PDB_00124 - 0.86 0.90 0.82 9 485 2 2 0 0 1
PDB_00128 - 0.80 0.71 0.91 10 485 1 0 1 0 4
PDB_00134 - 0.79 0.63 1.00 5 373 0 0 0 0 3
PDB_00138 - 0.79 0.63 1.00 5 373 0 0 0 0 3
PDB_00209 - 0.96 1.00 0.92 11 549 1 1 0 0 0
PDB_00243 - 0.71 0.58 0.88 7 622 1 0 1 0 5
PDB_00352 - 0.89 0.79 1.00 15 1210 0 0 0 0 4
PDB_00370 - 0.09 0.12 0.07 3 15179 45 12 31 2 22
PDB_00447 - 0.23 0.23 0.25 10 7100 30 6 24 0 34
PDB_00571 0.17 0.16 0.19 4 3300 17 6 11 0 21
PDB_00713 - 0.43 0.43 0.45 9 1996 11 0 11 0 12
PDB_00716 -0.01 0.00 0.00 0 2678 24 1 22 1 23
PDB_00804 - 0.22 0.24 0.21 12 15342 48 10 36 2 38
PDB_00828 0.88 0.78 1.00 21 2464 0 0 0 0 6
PDB_00829 0.86 0.75 1.00 18 2260 0 0 0 0 6
PDB_00842 - 0.79 0.63 1.00 5 373 0 0 0 0 3
PDB_00851 - 0.44 0.39 0.50 16 4721 16 0 16 0 25
PDB_00857 - 1.00 1.00 1.00 15 1066 0 0 0 0 0
PDB_00874 - 0.10 0.10 0.14 2 932 12 2 10 0 18
PDB_00886 - -0.01 0.00 0.00 0 4148 38 0 38 0 40
PDB_00918 - 0.75 0.57 1.00 4 321 0 0 0 0 3
PDB_01009 0.52 0.57 0.48 12 2460 13 5 8 0 9
PDB_01020 0.86 0.74 1.00 17 2261 1 0 0 1 6
PDB_01040 - 0.30 0.30 0.33 6 1110 12 0 12 0 14
PDB_01059 - 0.75 0.57 1.00 4 227 0 0 0 0 3
PDB_01070 - 0.31 0.30 0.33 16 12671 33 2 31 0 38
PDB_01073 0.81 0.74 0.89 25 4343 4 2 1 1 9
PDB_01092 0.69 0.65 0.74 34 10107 13 0 12 1 18
PDB_01194 - 0.93 0.93 0.93 14 481 1 1 0 0 1
PDB_01201 - 0.85 0.73 1.00 16 1112 0 0 0 0 6
PDB_01203 - 0.71 0.63 0.80 12 1161 3 2 1 0 7
PDB_01250 - 0.10 0.10 0.12 4 12056 30 7 23 0 37
PDB_01260 - 0.41 0.36 0.47 9 1811 10 0 10 0 16
PDB_01281 - -0.03 0.00 0.00 0 366 12 0 12 0 14
PDB_01299 - 0.74 0.67 0.83 10 891 2 1 1 0 5
PDB_01309 - -0.01 0.00 0.00 0 9118 62 9 53 0 39
RFA_00632 0.38 0.39 0.37 11 4065 19 2 17 0 17
RFA_00636 0.42 0.43 0.43 12 3977 16 2 14 0 16
RFA_00767 0.93 1.00 0.86 18 1870 3 3 0 0 0
RFA_00768 1.00 1.00 1.00 18 1873 0 0 0 0 0
RFA_00769 -0.01 0.00 0.00 0 1934 21 0 19 2 18
RFA_00770 -0.01 0.00 0.00 0 1999 20 0 17 3 18
RFA_00773 -0.01 0.00 0.00 0 1934 22 0 19 3 18
RFA_00779 0.87 0.94 0.81 17 1932 4 3 1 0 1
RFA_00808 1.00 1.00 1.00 16 2000 0 0 0 0 0
RFA_00809 0.79 0.81 0.76 13 2128 4 0 4 0 3

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Matthews Correlation Coeffient, Sensitivity and Positive Predictive Value have been calculated based on the paper by Gardener & Giegerich, 2004.