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

  1. Overview

  2. Performance Plots

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

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

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


Overview

Metric IPknot RNASLOpt
MCC 0.489 > 0.458
Average MCC ± 95% Confidence Intervals 0.564 ± 0.083 > 0.556 ± 0.082
Sensitivity 0.435 > 0.419
Positive Predictive Value 0.556 > 0.508
Total TP 513 > 493
Total TN 158584 > 158536
Total FP 421 < 487
Total FP CONTRA 53 < 58
Total FP INCONS 356 < 419
Total FP COMP 12 > 10
Total FN 665 < 685
P-value 3.56938820447e-08

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Performance plots


  1. Comparison of performance of IPknot and RNASLOpt. 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 IPknot and RNASLOpt).

  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 IPknot and RNASLOpt).

  3. Comparison of average Matthews Correlation Coefficients (MCCs) for IPknot and RNASLOpt. 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 IPknot and RNASLOpt).

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Performance of IPknot - scored higher in this pairwise comparison

1. Total counts & total scores for IPknot

Total Base Pair Counts
Total TP 513
Total TN 158584
Total FP 421
Total FP CONTRA 53
Total FP INCONS 356
Total FP COMP 12
Total FN 665
Total Scores
MCC 0.489
Average MCC ± 95% Confidence Intervals 0.564 ± 0.083
Sensitivity 0.435
Positive Predictive Value 0.556
Nr of predictions 53

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

RNA Chain Rfam family MCC SENS PPV TP TN FP FP CONTRA FP INCONS FP COMP FN
PDB_00005 0.71 0.71 0.71 10 932 4 0 4 0 4
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 - 0.73 0.55 1.00 6 429 0 0 0 0 5
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 - 0.17 0.20 0.18 2 485 9 2 7 0 8
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 - 0.76 0.58 1.00 7 623 0 0 0 0 5
PDB_00352 - 0.92 0.84 1.00 16 1209 0 0 0 0 3
PDB_00370 - 0.00 0.00 0.00 0 15225 0 0 0 0 25
PDB_00447 - 0.41 0.25 0.69 11 7124 5 0 5 0 33
PDB_00571 0.79 0.76 0.83 19 3298 4 2 2 0 6
PDB_00713 - 0.52 0.43 0.64 9 2002 5 0 5 0 12
PDB_00716 -0.01 0.00 0.00 0 2680 21 0 21 0 23
PDB_00804 - 0.23 0.24 0.23 12 15348 42 10 30 2 38
PDB_00828 0.90 0.81 1.00 22 2463 0 0 0 0 5
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 - 0.45 0.39 0.53 16 4723 14 0 14 0 25
PDB_00857 - 0.93 0.87 1.00 13 1068 0 0 0 0 2
PDB_00874 - 0.10 0.10 0.13 2 931 13 2 11 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 0.71 0.81 0.63 17 2458 10 5 5 0 4
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 - 0.75 0.57 1.00 4 227 0 0 0 0 3
PDB_01070 - 0.32 0.26 0.40 14 12685 21 0 21 0 40
PDB_01073 0.80 0.65 1.00 22 4349 1 0 0 1 12
PDB_01092 0.73 0.63 0.85 33 10114 8 1 5 2 19
PDB_01194 - 0.52 0.33 0.83 5 490 1 1 0 0 10
PDB_01201 - 0.61 0.45 0.83 10 1116 2 0 2 0 12
PDB_01203 - 0.74 0.68 0.81 13 1160 3 2 1 0 6
PDB_01250 - 0.18 0.15 0.22 6 12063 21 5 16 0 35
PDB_01260 - 0.58 0.48 0.71 12 1813 5 1 4 0 13
PDB_01281 - -0.03 0.00 0.00 0 366 12 0 12 0 14
PDB_01299 - 0.71 0.67 0.77 10 890 3 2 1 0 5
PDB_01309 - -0.01 0.00 0.00 0 9118 62 9 53 0 39
RFA_00632 0.42 0.36 0.50 10 4075 11 0 10 1 18
RFA_00636 0.65 0.64 0.67 18 3978 9 3 6 0 10
RFA_00767 0.74 0.56 1.00 10 1881 0 0 0 0 8
RFA_00768 1.00 1.00 1.00 18 1873 0 0 0 0 0
RFA_00769 0.54 0.56 0.53 10 1934 9 4 5 0 8
RFA_00770 0.64 0.50 0.82 9 2005 4 0 2 2 9
RFA_00773 0.61 0.56 0.67 10 1938 8 1 4 3 8
RFA_00779 0.74 0.56 1.00 10 1943 0 0 0 0 8
RFA_00808 0.75 0.56 1.00 9 2007 0 0 0 0 7
RFA_00809 0.47 0.38 0.60 6 2135 4 0 4 0 10

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Performance of RNASLOpt - scored lower in this pairwise comparison

1. Total counts & total scores for RNASLOpt

Total Base Pair Counts
Total TP 493
Total TN 158536
Total FP 487
Total FP CONTRA 58
Total FP INCONS 419
Total FP COMP 10
Total FN 685
Total Scores
MCC 0.458
Average MCC ± 95% Confidence Intervals 0.556 ± 0.082
Sensitivity 0.419
Positive Predictive Value 0.508
Nr of predictions 53

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2. Individual counts for RNASLOpt [ 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 - 0.75 0.65 0.87 13 765 2 0 2 0 7
PDB_00041 - 0.70 0.50 1.00 6 624 0 0 0 0 6
PDB_00053 - 0.73 0.55 1.00 6 429 0 0 0 0 5
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 - 0.70 0.50 1.00 5 491 0 0 0 0 5
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 - 0.67 0.45 1.00 5 556 0 0 0 0 6
PDB_00243 - 0.76 0.58 1.00 7 623 0 0 0 0 5
PDB_00352 - 0.39 0.37 0.44 7 1209 9 0 9 0 12
PDB_00370 - 0.00 0.00 0.00 0 15188 37 15 22 0 25
PDB_00447 - 0.30 0.25 0.37 11 7110 19 4 15 0 33
PDB_00571 0.87 0.80 0.95 20 3300 1 1 0 0 5
PDB_00713 - 0.45 0.43 0.47 9 1997 10 0 10 0 12
PDB_00716 -0.01 0.00 0.00 0 2680 22 0 21 1 23
PDB_00804 - 0.00 0.00 0.00 0 15350 52 6 44 2 50
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 - 0.45 0.39 0.53 16 4723 14 0 14 0 25
PDB_00857 - 0.77 0.60 1.00 9 1072 0 0 0 0 6
PDB_00874 - 0.10 0.10 0.13 2 931 13 2 11 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 0.90 0.90 0.90 19 2464 5 0 2 3 2
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 - 0.75 0.57 1.00 4 227 0 0 0 0 3
PDB_01070 - 0.33 0.30 0.36 16 12676 28 2 26 0 38
PDB_01073 0.56 0.47 0.67 16 4347 9 0 8 1 18
PDB_01092 0.74 0.63 0.87 33 10115 7 1 4 2 19
PDB_01194 - 0.77 0.60 1.00 9 487 0 0 0 0 6
PDB_01201 - 0.85 0.73 1.00 16 1112 0 0 0 0 6
PDB_01203 - 0.74 0.68 0.81 13 1160 3 2 1 0 6
PDB_01250 - 0.18 0.15 0.22 6 12063 21 5 16 0 35
PDB_01260 - 0.49 0.36 0.69 9 1817 4 0 4 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 0.59 0.57 0.62 16 4069 10 2 8 0 12
RFA_00636 0.65 0.64 0.67 18 3978 9 2 7 0 10
RFA_00767 0.63 0.56 0.71 10 1877 4 0 4 0 8
RFA_00768 0.61 0.56 0.67 10 1876 5 0 5 0 8
RFA_00769 0.59 0.56 0.63 10 1937 6 1 5 0 8
RFA_00770 0.47 0.39 0.58 7 2004 5 1 4 0 11
RFA_00773 0.59 0.56 0.63 10 1937 6 1 5 0 8
RFA_00779 0.74 0.56 1.00 10 1943 0 0 0 0 8
RFA_00808 0.75 0.56 1.00 9 2007 0 0 0 0 7
RFA_00809 0.40 0.38 0.43 6 2131 8 1 7 0 10

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