Table 2 Overlap of actives (mean and standard deviation) in the top-1% search outputs from SUM-OKA and TAN searches: number of active molecules retrieved by both SUM-OKA and TAN ("Overlap") or only by one of these two search methods.
From: Evaluation of a Bayesian inference network for ligand-based virtual screening
| Â | Number of actives | |||||
|---|---|---|---|---|---|---|
Dataset | Overlap | SUM-OKA | TAN | |||
MDDR | 131.58 | 154.10 | 56.41 | 47.71 | 35.89 | 27.40 |
MDDR-HOM | 234.54 | 262.74 | 63.53 | 91.37 | 21.39 | 42.69 |
MDDR-HET | 44.17 | 35.17 | 14.89 | 8.52 | 32.56 | 29.79 |
WOMBAT | 122.80 | 71.39 | 56.37 | 44.62 | 26.84 | 21.05 |