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

  1. Overview

  2. Performance Plots

  3. Performance of Vsfold5 - scored higher in this pairwise comparison

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

  5. Compile and download dataset for Vsfold5 & HotKnots [.zip] - may take several seconds...


Overview

Metric Vsfold5 HotKnots
MCC 0.534 > 0.453
Average MCC ± 95% Confidence Intervals 0.598 ± 0.089 > 0.555 ± 0.100
Sensitivity 0.505 > 0.445
Positive Predictive Value 0.572 > 0.469
Total TP 595 > 524
Total TN 158465 > 158389
Total FP 457 < 609
Total FP CONTRA 74 < 81
Total FP INCONS 372 < 512
Total FP COMP 11 < 16
Total FN 583 < 654
P-value 3.56938820447e-08

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Performance plots


  1. Comparison of performance of Vsfold5 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 Vsfold5 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 Vsfold5 and HotKnots).

  3. Comparison of average Matthews Correlation Coefficients (MCCs) for Vsfold5 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 Vsfold5 and HotKnots).

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Performance of Vsfold5 - scored higher in this pairwise comparison

1. Total counts & total scores for Vsfold5

Total Base Pair Counts
Total TP 595
Total TN 158465
Total FP 457
Total FP CONTRA 74
Total FP INCONS 372
Total FP COMP 11
Total FN 583
Total Scores
MCC 0.534
Average MCC ± 95% Confidence Intervals 0.598 ± 0.089
Sensitivity 0.505
Positive Predictive Value 0.572
Nr of predictions 53

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2. Individual counts for Vsfold5 [ 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 1 2 0 3
PDB_00018 - 0.68 0.55 0.85 11 1022 2 2 0 0 9
PDB_00020 - 0.80 0.70 0.93 14 765 1 0 1 0 6
PDB_00041 - 0.96 0.92 1.00 11 619 0 0 0 0 1
PDB_00053 - 1.00 1.00 1.00 11 424 0 0 0 0 0
PDB_00056 - 0.90 0.81 1.00 13 617 0 0 0 0 3
PDB_00123 - 0.35 0.33 0.38 12 4154 20 0 20 0 24
PDB_00124 - 0.86 0.90 0.82 9 485 2 2 0 0 1
PDB_00128 - 0.61 0.57 0.67 8 484 4 0 4 0 6
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 - 0.96 0.92 1.00 11 619 0 0 0 0 1
PDB_00352 - 0.72 0.68 0.76 13 1208 4 3 1 0 6
PDB_00370 - 0.10 0.12 0.08 3 15187 35 16 19 0 22
PDB_00447 - 0.95 0.91 1.00 40 7100 0 0 0 0 4
PDB_00571 0.87 0.80 0.95 20 3300 1 1 0 0 5
PDB_00713 - 0.69 0.62 0.76 13 1999 4 0 4 0 8
PDB_00716 0.17 0.17 0.18 4 2679 19 0 18 1 19
PDB_00804 - 0.19 0.20 0.18 10 15344 48 6 40 2 40
PDB_00828 0.86 0.74 1.00 20 2465 0 0 0 0 7
PDB_00829 0.83 0.79 0.86 19 2256 3 2 1 0 5
PDB_00842 - 0.79 0.63 1.00 5 373 0 0 0 0 3
PDB_00851 - 0.54 0.44 0.67 18 4726 9 0 9 0 23
PDB_00857 - 1.00 1.00 1.00 15 1066 0 0 0 0 0
PDB_00874 - -0.02 0.00 0.00 0 932 14 0 14 0 20
PDB_00886 - 0.64 0.60 0.69 24 4151 11 0 11 0 16
PDB_00918 - 0.75 0.57 1.00 4 321 0 0 0 0 3
PDB_01009 0.90 0.90 0.90 19 2464 3 0 2 1 2
PDB_01020 0.82 0.78 0.86 18 2257 4 2 1 1 5
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 - 0.43 0.37 0.50 20 12680 20 0 20 0 34
PDB_01073 0.56 0.47 0.67 16 4347 9 1 7 1 18
PDB_01092 0.73 0.69 0.77 36 10106 12 2 9 1 16
PDB_01194 - 0.73 0.60 0.90 9 486 1 1 0 0 6
PDB_01201 - 0.79 0.64 1.00 14 1114 0 0 0 0 8
PDB_01203 - 0.73 0.63 0.86 12 1162 2 2 0 0 7
PDB_01250 - 0.16 0.15 0.18 6 12056 30 3 25 2 35
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 - 0.90 0.87 0.93 13 889 1 1 0 0 2
PDB_01309 - -0.01 0.00 0.00 0 9125 55 12 43 0 39
RFA_00632 -0.01 0.00 0.00 0 4073 22 0 22 0 28
RFA_00636 0.58 0.57 0.59 16 3978 11 1 10 0 12
RFA_00767 0.21 0.22 0.22 4 1873 14 2 12 0 14
RFA_00768 -0.01 0.00 0.00 0 1875 16 1 15 0 18
RFA_00769 0.50 0.50 0.50 9 1935 9 4 5 0 9
RFA_00770 0.65 0.56 0.77 10 2003 3 3 0 0 8
RFA_00773 -0.01 0.00 0.00 0 1936 19 1 16 2 18
RFA_00779 0.69 0.61 0.79 11 1939 3 3 0 0 7
RFA_00808 1.00 1.00 1.00 16 2000 0 0 0 0 0
RFA_00809 0.45 0.44 0.47 7 2130 8 1 7 0 9

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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.