Molecular Graph Generation on MOSES
100Uniqueness
Training Set
Updated 1mo ago
Evaluation Results
| Method | Links | ||||||||
|---|---|---|---|---|---|---|---|---|---|
2026.01 | 100 | 100 | 0 | 100 | 0.01 | 0.64 | 99.1 | - | |
2026.01 | 100 | 85.7 | 95 | 97.1 | 1.19 | 0.52 | 14.8 | - | |
2026.01 | 100 | 88.3 | 97.7 | 95.6 | 1.44 | 0.5 | 15.1 | - | |
2025.12 | 100 | 100 | 99.9 | 97.8 | 1 | 0.53 | 10 | - | |
2025.12 | 100 | 85.7 | 95 | 97.1 | 1.19 | 0.52 | 14.8 | - | |
2025.12 | 100 | 86.8 | 78.2 | 99 | 1 | 0.56 | 2.2 | - | |
2025.12 | 100 | 99.42 | 61.43 | 99.59 | 0.16 | 0.64 | 3.4 | - | |
2026.02 | 100 | - | 95 | - | - | 0.52 | 14.8 | - | |
2026.02 | 100 | - | 97.7 | - | - | 0.5 | 15.1 | - | |
2026.02 | 100 | - | 79.4 | - | - | 0.55 | 2.9 | - | |
2026.02 | 100 | - | 81.1 | - | - | 0.52 | 3.6 | - | |
2026.06 | 100 | 86.8 | 78.2 | - | 1 | - | - | - | |
| 100 | 95.25 | 98.72 | - | 19.2 | - | - | - | ||
2026.01 | 99.9 | 90.5 | 92.6 | 99.1 | 1.27 | 0.54 | 16 | 19,000 | |
2026.01 | 99.9 | 92.8 | 92.1 | 98.9 | 1.95 | 0.55 | 14.4 | 18,000 | |
2026.01 | 99.9 | 88.4 | 90.5 | 98.9 | 1.43 | 0.55 | 12.3 | 310 | |
2025.12 | 99.9 | 83.4 | 96.4 | 94.8 | 1.48 | 0.5 | 16.4 | - | |
2026.02 | 99.9 | - | 92.6 | - | - | 0.54 | 16 | - | |
2026.02 | 99.9 | - | 92.1 | - | - | 0.55 | 14.4 | - | |
2026.02 | 99.9 | - | 98.1 | - | - | 0.58 | 15.3 | - | |
2025.12 | 99.8 | 97.7 | 69.5 | 99.7 | 0.57 | 0.58 | 5.9 | - | |
2025.12 | 99.8 | 96.4 | - | 95 | 1.22 | 0.54 | 12.7 | - | |
2026.02 | 99.8 | - | 89 | - | - | 0.59 | 10 | - |