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

  1. Overview

  2. Performance Plots

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

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

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


Overview

Metric CentroidFold ProbKnot
MCC 0.574 > 0.524
Average MCC ± 95% Confidence Intervals 0.611 ± 0.097 > 0.529 ± 0.104
Sensitivity 0.557 > 0.554
Positive Predictive Value 0.593 > 0.497
Total TP 845 > 840
Total TN 940696 > 940431
Total FP 729 < 1070
Total FP CONTRA 169 < 276
Total FP INCONS 411 < 574
Total FP COMP 149 < 220
Total FN 672 < 677
P-value 3.56938820447e-08

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Performance plots


  1. Comparison of performance of CentroidFold and ProbKnot. 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 CentroidFold and ProbKnot).

  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 CentroidFold and ProbKnot).

  3. Comparison of average Matthews Correlation Coefficients (MCCs) for CentroidFold and ProbKnot. 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 CentroidFold and ProbKnot).

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Performance of CentroidFold - scored higher in this pairwise comparison

1. Total counts & total scores for CentroidFold

Total Base Pair Counts
Total TP 845
Total TN 940696
Total FP 729
Total FP CONTRA 169
Total FP INCONS 411
Total FP COMP 149
Total FN 672
Total Scores
MCC 0.574
Average MCC ± 95% Confidence Intervals 0.611 ± 0.097
Sensitivity 0.557
Positive Predictive Value 0.593
Nr of predictions 31

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

RNA Chain Rfam family MCC SENS PPV TP TN FP FP CONTRA FP INCONS FP COMP FN
2KRL_A - 0.91 0.87 0.95 20 2003 9 1 0 8 3
2LC8_A 0.51 0.39 0.70 7 518 3 1 2 0 11
2M58_A - -0.02 0.00 0.00 0 538 6 0 6 0 12
3IYQ_A 0.29 0.39 0.22 20 22347 86 39 34 13 31
3IZ4_A 0.60 0.57 0.64 54 25451 38 16 15 7 41
3J0L_a - 0.41 0.36 0.50 4 403 5 3 1 1 7
3J20_0 0.54 0.57 0.52 12 1196 12 3 8 1 9
3J20_2 0.70 0.69 0.70 286 421962 177 23 97 57 126
3J3D_C 0.73 0.79 0.68 15 946 7 3 4 0 4
3J3E_8 0.12 0.13 0.13 2 2726 22 4 10 8 13
3J3F_8 0.36 0.47 0.28 9 4729 37 12 11 14 10
3NKB_B - 0.66 0.68 0.65 13 715 7 0 7 0 6
3NPB_A 0.87 0.84 0.91 31 2244 8 1 2 5 6
3O58_3 0.44 0.41 0.47 9 4745 11 1 9 1 13
3PDR_A 0.88 0.86 0.90 43 4792 7 2 3 2 7
3RKF_A 0.91 0.83 1.00 20 846 0 0 0 0 4
3SD1_A 0.70 0.69 0.71 20 1505 8 4 4 0 9
3U4M_B - 0.81 0.77 0.85 17 1256 5 0 3 2 5
3W1K_J 0.97 0.97 0.97 30 1647 1 1 0 0 1
3W3S_B 0.95 0.91 1.00 30 1959 1 0 0 1 3
3ZEX_C 0.48 0.34 0.67 10 5359 6 1 4 1 19
3ZEX_B - 0.27 0.25 0.31 85 421074 210 38 155 17 261
4A1C_2 0.22 0.25 0.19 5 4490 29 9 12 8 15
4AOB_A 0.50 0.48 0.54 14 1411 13 3 9 1 15
4ATO_G - 0.61 0.57 0.67 4 214 2 0 2 0 3
4ENB_A 0.85 0.73 1.00 11 461 1 0 0 1 4
4ENC_A 0.85 0.73 1.00 11 485 1 0 0 1 4
4FRG_B 0.75 0.71 0.81 17 1181 4 3 1 0 7
4FRN_A 0.80 0.71 0.91 20 1826 2 1 1 0 8
4JF2_A 0.89 0.79 1.00 19 1063 0 0 0 0 5
4JRC_A - 0.38 0.41 0.39 7 604 11 0 11 0 10

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Performance of ProbKnot - scored lower in this pairwise comparison

1. Total counts & total scores for ProbKnot

Total Base Pair Counts
Total TP 840
Total TN 940431
Total FP 1070
Total FP CONTRA 276
Total FP INCONS 574
Total FP COMP 220
Total FN 677
Total Scores
MCC 0.524
Average MCC ± 95% Confidence Intervals 0.529 ± 0.104
Sensitivity 0.554
Positive Predictive Value 0.497
Nr of predictions 31

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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
2KRL_A - 0.82 0.87 0.77 20 1998 15 6 0 9 3
2LC8_A -0.03 0.00 0.00 0 513 15 3 12 0 18
2M58_A - -0.02 0.00 0.00 0 529 15 0 15 0 12
3IYQ_A 0.24 0.33 0.18 17 22346 97 41 36 20 34
3IZ4_A 0.59 0.61 0.57 58 25435 49 17 26 6 37
3J0L_a - 0.60 0.64 0.58 7 399 6 4 1 1 4
3J20_0 0.54 0.57 0.52 12 1196 12 3 8 1 9
3J20_2 0.61 0.61 0.60 253 421947 227 32 136 59 159
3J3D_C 0.46 0.53 0.42 10 944 14 6 8 0 9
3J3E_8 -0.01 0.00 0.00 0 2718 37 6 18 13 15
3J3F_8 0.39 0.47 0.33 9 4734 38 9 9 20 10
3NKB_B - 0.69 0.74 0.67 14 714 7 0 7 0 5
3NPB_A 0.79 0.73 0.87 27 2247 9 0 4 5 10
3O58_3 0.38 0.50 0.29 11 4726 42 10 17 15 11
3PDR_A 0.88 0.92 0.85 46 4786 10 5 3 2 4
3RKF_A 0.87 0.83 0.91 20 844 2 2 0 0 4
3SD1_A 0.66 0.69 0.65 20 1502 11 6 5 0 9
3U4M_B - 0.58 0.59 0.59 13 1254 9 2 7 0 9
3W1K_J 0.97 0.97 0.97 30 1647 1 1 0 0 1
3W3S_B 0.98 0.97 1.00 32 1957 1 0 0 1 1
3ZEX_C 0.48 0.52 0.45 15 5341 22 4 14 4 14
3ZEX_B - 0.35 0.38 0.33 133 420946 320 82 191 47 213
4A1C_2 0.17 0.25 0.13 5 4477 49 13 21 15 15
4AOB_A 0.60 0.59 0.63 17 1410 11 4 6 1 12
4ATO_G - 0.38 0.43 0.38 3 212 5 5 0 0 4
4ENB_A 0.81 0.73 0.92 11 460 1 1 0 0 4
4ENC_A 0.52 0.53 0.53 8 481 8 0 7 1 7
4FRG_B 0.38 0.38 0.41 9 1180 13 6 7 0 15
4FRN_A 0.49 0.46 0.54 13 1824 11 6 5 0 15
4JF2_A 0.91 0.92 0.92 22 1058 2 2 0 0 2
4JRC_A - 0.28 0.29 0.31 5 606 11 0 11 0 12

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