| Dataset Name | SOTA Method | Metric | Trend | ||
|---|---|---|---|---|---|
| ZINC250K (test) | MRNN | 1st Order Metric0.844 | 33 | 3mo ago | |
| PMV21 JNK3 (test) | Aug-Mem | AUC@10.4047 | 19 | 22d ago | |
| MOSES ~1.5M molecules (test) | GEM | C.V.U.N. Score85 | 16 | 2mo ago | |
| PMV21 GSK3B (test) | AUC@168.08 | 13 | 22d ago | ||
| PMV21 DRD2 (test) | AUC@197.06 | 13 | 22d ago | ||
| PMV21 QED (test) | AUC@194.48 | 13 | 22d ago | ||
| TOMG-Bench | RePO | QED0.236 | 7 | 2mo ago | |
| Perov-5 (test) | DiffCSP | SR5100 | 4 | 3mo ago | |
| MP-20 (test) | DiffCSP | SR@582 | 3 | 3mo ago | |
| Carbon-24 (test) | DiffCSP | SR550 | 3 | 3mo ago | |
| Pharmacokinetic and toxicity properties (AMES, BBBP, CYP3A4, DILI, HIA, PGP) | HierVAE | AMES Accuracy48.2 | 2 | 3mo ago |
