Table 2.
Unicolumn statistics of training and test set for 2D QSAR studies.
| Data set | Average | Max | Min | Std. dev. | Sum |
|---|---|---|---|---|---|
| 2D QSAR | |||||
| Training | 1.6127 | 2.6542 | 0.6503 | 0.4426 | 41.9299 |
| Test | 1.7765 | 2.2095 | 1.1072 | 0.3889 | 12.4355 |
|
| |||||
| 3D QSAR | |||||
| Training | 1.5401 | 2.2095 | 0.6503 | 0.4163 | 36.9636 |
| Test | 1.9335 | 2.6542 | 1.3945 | 0.3452 | 17.4018 |