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Table 2 Average Number of Queries with A Similarity > = 0.7

From: Predicting the points of interaction of small molecules in the NF-κB pathway

Descriptor

Minimum Cluster Size

 

1

2

3

4

5

BCUT

54.32

51.68

48.08

45.12

40

GCUT

47.72

42.96

38.52

31.16

26.36

BCUT with GCUT

47.44

42.92

39.04

31.92

29.64

GCUT with Properties

42.72

38.56

30.76

24.64

19.52

ECFP4

13.24

12.08

10.12

9

7.96

ECFP4 with Properties

19.28

17.12

14.92

13.08

11.68

Properties

53.68

50.84

42.96

37.48

33.52

  1. Table showing the average number of query compounds (out of 60) that have a similarity > = 0.7 to the most similar clusters
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BMC Systems Biology

ISSN: 1752-0509

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