Table 4. Efficiency of docking scores and rescores in prediction of training set compounds as active, moderately active and inactive.

	Scoring method	Dataset validated	Most active	Moderately active	Least active
Score	AutoDock Vina	Most Active	5	3	-
	AutoDock Vina	Least active	1	4	4
	Chem	Most active	6	2	-
	Chem	Least active	1	6	2
	ASP	Most active	5	2	1
	ASP	Least active	2	2	5
	GOLD	Most active	4	3	1
	GOLD	Least active	1	4	4
	Consensus	Most active	5	3	-
	Consensus	Least active	1	4	4
Rescore	AutoDock Vina	Most active	6	2	-
	AutoDock Vina	Least active	-	5	4
	Chem	Most active	8	-	-
	Chem	Least active	-	5	4
	ASP	Most active	5	3	-
	ASP	Least active	1	1	7
	GOLD	Most active	7	1	-
	GOLD	Least active	-	2	7
	Consensus	Most active	7	1	-
	Consensus	Least active	1	4	4