From: How can SHAP values help to shape metabolic stability of chemical compounds?
Dataset | Human | Rat | |||
---|---|---|---|---|---|
Model | Representation | Class | Class. via regression | Class | Class. via regression |
SVM | MACCS | 0.745 | 0.695 | 0.676 | 0.686 |
KRFP | 0.759 | 0.672 | 0.676 | 0.751 | |
Trees | MACCS | 0.737 | 0.692 | 0.659 | 0.686 |
KRFP | 0.734 | 0.661 | 0.670 | 0.676 |