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. 2020 Dec 9;34(2):330–344. doi: 10.1021/acs.chemrestox.0c00253

Table 9. Overall Performance of Combined Workflow for Ternary Prediction of Skin Sensitization Potential on the Test Set1.

ε validity efficiency ACC MCC CCR SE SP NPV PPV
0.10 0.92 0.42 0.90 0.78 0.91 0.91 0.93 0.92 0.84
0.20 0.80 0.71 0.80 0.63 0.79 0.79 0.89 0.87 0.71
0.30 0.66 0.90 0.73 0.54 0.70 0.70 0.86 0.84 0.64
1

All performance measures are reported as the mean of the corresponding performance measure over all classes investigated.