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

  1. Overview

  2. Performance Plots

  3. Performance of RSpredict(20) - scored higher in this pairwise comparison

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

  5. Compile and download dataset for RSpredict(20) & Pknots [.zip] - may take several seconds...


Overview

Metric RSpredict(20) Pknots
MCC 0.664 > 0.590
Average MCC ± 95% Confidence Intervals 0.636 ± 0.098 > 0.629 ± 0.104
Sensitivity 0.600 < 0.635
Positive Predictive Value 0.742 > 0.557
Total TP 544 < 575
Total TN 79194 > 78895
Total FP 303 < 608
Total FP CONTRA 71 < 143
Total FP INCONS 118 < 314
Total FP COMP 114 < 151
Total FN 362 > 331
P-value 3.56938820447e-08

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Performance plots


  1. Comparison of performance of RSpredict(20) and Pknots. 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 RSpredict(20) and Pknots).

  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 RSpredict(20) and Pknots).

  3. Comparison of average Matthews Correlation Coefficients (MCCs) for RSpredict(20) and Pknots. 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 RSpredict(20) and Pknots).

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Performance of RSpredict(20) - scored higher in this pairwise comparison

1. Total counts & total scores for RSpredict(20)

Total Base Pair Counts
Total TP 544
Total TN 79194
Total FP 303
Total FP CONTRA 71
Total FP INCONS 118
Total FP COMP 114
Total FN 362
Total Scores
MCC 0.664
Average MCC ± 95% Confidence Intervals 0.636 ± 0.098
Sensitivity 0.600
Positive Predictive Value 0.742
Nr of predictions 38

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2. Individual counts for RSpredict(20) [ download as .csv ]

RNA Chain Rfam family MCC SENS PPV TP TN FP FP CONTRA FP INCONS FP COMP FN
2KDQ_B 0.89 0.80 1.00 8 166 0 0 0 0 2
2L94_A 0.53 0.50 0.60 9 342 7 0 6 1 9
2WRQ_Y 1.00 1.00 1.00 9 1143 12 0 0 12 0
2XKV_B 0.00 0.00 0.00 0 1831 4 1 3 0 11
2XQD_Y 0.98 0.95 1.00 20 1109 1 0 0 1 1
2XXA_G 0.50 0.26 1.00 9 2036 0 0 0 0 26
3A2K_C 0.88 0.86 0.90 19 1087 2 0 2 0 3
3AMU_B 0.69 0.53 0.91 10 1146 2 0 1 1 9
3GX2_A 0.40 0.21 0.75 6 1441 2 1 1 0 22
3IVN_B 0.91 0.87 0.95 20 882 1 1 0 0 3
3IZF_C 0.94 0.91 0.97 32 2607 4 0 1 3 3
3J20_0 0.90 0.90 0.90 19 1198 3 1 1 1 2
3J20_1 0.67 0.50 0.91 10 1101 2 0 1 1 10
3J2L_3 0.71 0.59 0.87 20 2997 6 0 3 3 14
3J3D_C 0.82 0.84 0.80 16 948 4 3 1 0 3
3J3E_7 0.82 0.79 0.84 27 2709 7 0 5 2 7
3J3E_8 -0.01 0.00 0.00 0 2724 19 5 13 1 15
3J3F_8 0.42 0.47 0.38 9 4737 26 9 6 11 10
3J3F_7 0.94 0.94 0.94 34 2898 3 1 1 1 2
3JYV_7 0.97 0.95 1.00 19 1092 2 0 0 2 1
3JYX_3 0.80 0.80 0.80 12 2363 16 0 3 13 3
3JYX_4 0.59 0.75 0.47 9 4737 33 9 1 23 3
3LA5_A 0.89 0.80 1.00 20 934 0 0 0 0 5
3NPB_A -0.01 0.00 0.00 0 2272 6 1 5 0 37
3O58_3 0.38 0.50 0.30 11 4727 29 15 11 3 11
3O58_2 0.93 0.94 0.94 29 2723 10 0 2 8 2
3PDR_A 0.80 0.70 0.92 35 4802 5 1 2 2 15
3RKF_A 0.91 0.88 0.95 21 844 1 1 0 0 3
3SD1_A 0.82 0.86 0.78 25 1501 7 5 2 0 4
3ZEX_D 0.88 0.83 0.94 29 2765 7 0 2 5 6
3ZEX_C 0.34 0.31 0.38 9 5350 19 3 12 4 20
3ZND_W 0.47 0.38 0.60 3 1186 9 0 2 7 5
4A1C_2 0.25 0.30 0.21 6 4487 30 12 11 7 14
4A1C_3 0.60 0.49 0.75 18 2739 8 0 6 2 19
4AOB_A 0.33 0.21 0.55 6 1426 5 1 4 0 23
4ENB_A 0.54 0.40 0.75 6 464 2 0 2 0 9
4ENC_A 0.51 0.40 0.67 6 487 3 0 3 0 9
4FRG_B 0.19 0.13 0.33 3 1193 6 1 5 0 21

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Performance of Pknots - scored lower in this pairwise comparison

1. Total counts & total scores for Pknots

Total Base Pair Counts
Total TP 575
Total TN 78895
Total FP 608
Total FP CONTRA 143
Total FP INCONS 314
Total FP COMP 151
Total FN 331
Total Scores
MCC 0.590
Average MCC ± 95% Confidence Intervals 0.629 ± 0.104
Sensitivity 0.635
Positive Predictive Value 0.557
Nr of predictions 38

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

RNA Chain Rfam family MCC SENS PPV TP TN FP FP CONTRA FP INCONS FP COMP FN
2KDQ_B 1.00 1.00 1.00 10 164 0 0 0 0 0
2L94_A 0.94 0.94 0.94 17 339 2 0 1 1 1
2WRQ_Y 1.00 1.00 1.00 9 1143 13 0 0 13 0
2XKV_B 0.21 0.27 0.17 3 1817 33 3 12 18 8
2XQD_Y 0.98 0.95 1.00 20 1109 1 0 0 1 1
2XXA_G 0.32 0.34 0.32 12 2008 26 1 24 1 23
3A2K_C 0.50 0.55 0.48 12 1083 13 3 10 0 10
3AMU_B 1.00 1.00 1.00 19 1138 3 0 0 3 0
3GX2_A 0.55 0.57 0.55 16 1420 14 4 9 1 12
3IVN_B 0.91 0.87 0.95 20 882 1 0 1 0 3
3IZF_C 0.89 0.91 0.86 32 2603 9 0 5 4 3
3J20_0 0.95 0.95 0.95 20 1198 2 1 0 1 1
3J20_1 1.00 1.00 1.00 20 1092 1 0 0 1 0
3J2L_3 0.79 0.79 0.79 27 2986 12 1 6 5 7
3J3D_C 0.46 0.53 0.42 10 944 14 5 9 0 9
3J3E_7 0.56 0.56 0.58 19 2708 16 2 12 2 15
3J3E_8 0.10 0.13 0.09 2 2720 33 5 15 13 13
3J3F_8 0.42 0.53 0.33 10 4731 37 10 10 17 9
3J3F_7 0.32 0.33 0.32 12 2896 27 2 24 1 24
3JYV_7 0.97 0.95 1.00 19 1092 2 0 0 2 1
3JYX_3 0.37 0.53 0.27 8 2348 26 17 5 4 7
3JYX_4 0.33 0.58 0.19 7 4720 41 22 7 12 5
3LA5_A 0.94 0.88 1.00 22 932 0 0 0 0 3
3NPB_A 0.84 0.81 0.88 30 2244 9 0 4 5 7
3O58_3 0.32 0.45 0.24 10 4722 39 18 14 7 12
3O58_2 0.93 0.90 0.97 28 2725 3 0 1 2 3
3PDR_A 0.64 0.64 0.65 32 4791 19 4 13 2 18
3RKF_A 0.91 0.88 0.95 21 844 1 0 1 0 3
3SD1_A 0.78 0.76 0.81 22 1506 5 1 4 0 7
3ZEX_D 0.31 0.34 0.30 12 2756 28 5 23 0 23
3ZEX_C 0.10 0.14 0.08 4 5322 54 13 35 6 25
3ZND_W 0.24 0.38 0.16 3 1172 25 9 7 9 5
4A1C_2 0.33 0.40 0.29 8 4488 36 9 11 16 12
4A1C_3 0.28 0.30 0.28 11 2723 30 4 25 1 26
4AOB_A 0.19 0.21 0.21 6 1409 23 3 19 1 23
4ENB_A 1.00 1.00 1.00 15 457 2 0 0 2 0
4ENC_A 0.97 1.00 0.94 15 480 1 1 0 0 0
4FRG_B 0.55 0.50 0.63 12 1183 7 0 7 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.