Virtual Screening on MoleculeNet HIV (test)
0.953BSDS (B/N=0.01)Random
Evaluation Results
| Method | Links | ||||
|---|---|---|---|---|---|
| RandomSeed=0, Bootstrap Seeds=1000, Confidence Interval=95% BCa2026.03 | 0.953 | 0.895 | 0.782 | 0.819 | |
| GenerativeSeed=0, Bootstrap Seeds=1000, Confidence Interval=95% BCa2026.03 | 0.906 | 0.822 | 0.548 | 0.67 | |
| BSDS-RecursiveSeed=0, Bootstrap Seeds=1000, Confidence Interval=95% BCa2026.03 | 0.468 | 0.298 | 0.289 | 0.323 | |
| Informed-PriorSeed=0, Bootstrap Seeds=1000, Confidence Interval=95% BCa2026.03 | 0.297 | 0.232 | 0.303 | 0.178 | |
| BSDS-GuidedSeed=0, Bootstrap Seeds=1000, Confidence Interval=95% BCa2026.03 | 0.236 | 0.184 | 0.248 | 0.234 | |
| EnsembleSeed=0, Bootstrap Seeds=1000, Confidence Interval=95% BCa2026.03 | 0.113 | 0.094 | 0.213 | 0.102 | |
| RetrievalSeed=0, Bootstrap Seeds=1000, Confidence Interval=95% BCa2026.03 | 0.056 | 0.033 | 0.138 | 0.091 | |
| Greedy-MLSeed=0, Bootstrap Seeds=1000, Confidence Interval=95% BCa2026.03 | 0.003 | 0.01 | 0.121 | 0.046 |