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. Author manuscript; available in PMC: 2022 Jan 4.
Published in final edited form as: Mol Pharm. 2020 Dec 16;18(1):403–415. doi: 10.1021/acs.molpharmaceut.0c01013

Table 1.

Median values for each model and metric color coded by scale.

AC SVC ADA BNB DL KNN RF
ACC 0.827 0.841 0.811 0.801 0.825 0.829 0.832
AUC 0.887 0.826 0.772 0.766 0.796 0.810 0.807
Cohen’s Kappa 0.627 0.643 0.557 0.540 0.597 0.617 0.616
MCC 0.636 0.646 0.563 0.544 0.604 0.619 0.620
Precision 0.782 0.796 0.775 0.750 0.778 0.765 0.795
Recall 0.833 0.817 0.732 0.730 0.773 0.810 0.775
Specificity 0.841 0.857 0.863 0.845 0.855 0.835 0.868
F1-Score 0.791 0.798 0.749 0.738 0.766 0.785 0.781

AC = Assay Central (Bayesian), rf = Random Forest, knn = k-Nearest Neighbors, svc = Support Vector Classification, bnb = Naïve Bayesian, ada = AdaBoosted Decision Trees, DL = Deep Learning.