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

Table 2. Overall Performance during 10-Fold Cross-validation of Binary Aggregated Mondrian CP Classifier Differentiating Nonsensitizers from Sensitizers¹.

ε	validity	efficiency	ACC	MCC	CCR	SE	SP	NPV	PPV
0.05	0.96 (0.02)	0.28 (0.05)	0.88 (0.07)	0.73 (0.15)	0.87 (0.08)	0.86 (0.13)	0.89 (0.09)	0.93 (0.06)	0.80 (0.14)
0.10	0.91 (0.02)	0.51 (0.05)	0.83 (0.03)	0.66 (0.06)	0.84 (0.03)	0.84 (0.07)	0.83 (0.06)	0.89 (0.05)	0.76 (0.05)
0.20	0.82 (0.03)	0.83 (0.04)	0.78 (0.03)	0.56 (0.07)	0.78 (0.04)	0.78 (0.09)	0.78 (0.05)	0.84 (0.05)	0.71 (0.04)
0.30	0.73 (0.04)	0.96 (0.02)	0.76 (0.03)	0.51 (0.06)	0.76 (0.03)	0.76 (0.06)	0.76 (0.05)	0.82 (0.04)	0.69 (0.05)

Standard deviation in brackets next to the values.

Table 2. Overall Performance during 10-Fold Cross-validation of Binary Aggregated Mondrian CP Classifier Differentiating Nonsensitizers from Sensitizers1.