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Table 4 Average precision and recall in the Top-k positions achieved for WOMBAT using the activity-only based model

From: Target prediction utilising negative bioactivity data covering large chemical space

Top-k positions

Recall (%)

Precision (%)

3

50.0

48.5

6

58.8

41.1

9

62.5

36.3

27

72.5

24.8

54

79.2

18.7

72

82.2

16.3

90

84.2

14.0

180

90.9

7.9

  1. Increasing the number of top-k positions increases the recall and decreases the precision of the models