Skip to main content
. 2021 Aug 11;13(8):1237. doi: 10.3390/pharmaceutics13081237

Table 3.

The performance of classification models developed on Dataset_3 for discriminating B3PPs and CPPs; models were developed using different machine learning techniques.

Methods Training Dataset_3 Validation Dataset_3
Sens Spec Acc AUROC MCC Sens Spec Acc AUROC MCC
RF 86.97 85.08 85.25 0.93 0.51 81.48 83.08 82.93 0.90 0.44
XGB 72.55 93.82 91.88 0.92 0.58 72.22 92.00 90.20 0.892 0.52
LR 80.93 89.73 88.93 0.92 0.54 83.33 89.40 88.85 0.93 0.55
SVC 80.00 84.75 84.32 0.90 0.45 85.18 82.15 82.43 0.90 0.45
KNN 83.72 80.76 81.03 0.88 0.43 79.63 78.44 78.54 0.84 0.37
GNB 80.46 75.74 76.20 0.84 0.35 83.33 72.67 73.65 0.86 0.34
DT 85.11 65.00 66.83 0.82 0.30 64.82 63.20 63.40 0.72 0.20