TABLE 5.

Top eight performing models evaluation on the external validation set.

Feature Subset	Model Name	External Validation
		AUC	ACC (%)	SEN (%)	SPE (%)	MCC
DS + RDKit_237	BRF	0.8842	76.32	86.84	72.81	0.5231
	EEC	0.8446	72.37	73.68	71.93	0.4041
	BBC + GBDT	0.9164	83.55	81.58	84.21	0.6095
	BBC + LightGBM	0.8910	80.92	76.32	82.46	0.5445
MOE + RDKit_196	BRF	0.8691	76.97	78.95	76.32	0.4943
	BBC + GBDT	0.8663	77.63	73.68	78.95	0.4804
SubFPC	BRF	0.8909	76.97	84.21	74.56	0.5192
	BBC + GBDT	0.8989	79.61	76.32	80.70	0.5229