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Table 5 Distribution of labels in the trypsin-like protease data set for different activity cutoffs

From: A ranking method for the concurrent learning of compounds with various activity profiles

  Percentage of compounds with label
Cutoff 3 2 1 0
5.6 15 25 5 55
6.1 25 23 4 48
6.6 32 17 3 48
  1. In this overview avoiding Thr is more important than Try. In the reverse case the values for the labels 2 and 1 just have to be switched. The activity cutoff is given in pK i .