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Table 12 Enrichment values of (BEDROC α = 20) and (EF 1%) using our proposed method on MDDR1, MDDR2, MUV and DUD data sets

From: Condorcet and borda count fusion method for ligand-based virtual screening

 

MDDR1

MDDR2

MUV

DUD

BEDROC (α = 20)

EF (1%)

BEDROC (α = 20)

EF (1%)

BEDROC (α = 20)

EF (1%)

BEDROC (α = 20)

EF (1%)

Method

Mean

Median

Mean

Median

Mean

Median

Mean

Median

Mean

Median

Mean

Median

Mean

Median

Mean

Median

TAN

0.49

0.47

80.52

84.99

0.30

0.35

23.25

22.98

0.38

0.36

16.94

16.87

0.17

0.15

20.87

19.55

Top10

0.50

0.54

81.85

89.10

0.32

0.36

24.85

23.11

0.40

0.37

17.99

16.64

0.19

0.18

21.67

20.83

Top20

0.52

0.49

86.31

89.10

0.35

0.36

23.99

23.79

0.41

0.35

18.70

16.90

0.21

0.16

22.59

20.74

Top50

0.55

0.47

86.99

88.55

0.36

0.34

24.72

21.45

0.42

0.39

17.72

17.01

0.29

0.28

23.22

21.05

Top100

0.63

0.62

91.17

90.05

0.47

0.51

27.87

23.99

0.45

0.40

19.94

18.64

0.35

0.30

25.61

22.14