Table 1 Slopes (b) and squared correlation coefficients (r2) for log-log plots of the overlap of molecules and the overlap of scaffolds using similarity fusion and group fusion
| Â | Molecules | Scaffolds | ||
|---|---|---|---|---|
| Â | b | r 2 | b | r 2 |
| Â | Similarity fusion | Â | Â | |
WOMBAT top-1% | -1.98 | 0.966 | -1.95 | 0.965 |
WOMBAT top-5% | -1.75 | 0.919 | -1.71 | 0.893 |
MDDR top-1% | -2.17 | 0.959 | -2.16 | 0.950 |
MDDR top-5% | -1.89 | 0.906 | -1.89 | 0.881 |
| Â | Â | Group fusion | Â | Â |
WOMBAT top-1% | -2.49 | 0.957 | -2.46 | 0.946 |
WOMBAT top-5% | -2.12 | 0.951 | -2.09 | 0.921 |
MDDR top-1% | -2.32 | 0.952 | -2.37 | 0.938 |
MDDR top-5% | -2.01 | 0.980 | -2.00 | 0.968 |