Table 3. Number of Outlying Compounds with Large Differences between Experimental and Predicted Values for the Consensus Models.
OCHEM |
ENAMINE |
|||
---|---|---|---|---|
significance value | estimated | observed | estimated | observed |
p = 10–5 | 0.22 | 45 | 0.22 | 52 |
p = 10–4 | 2.2 | 82 | 2.2 | 99 |
p = 10–3 | 22 | 165 | 22 | 183 |
p = 0.01 | 219 | 394 | 224 | 427 |
p = 0.05 | 1094 | 957 | 1120 | 1034 |