Reaction product prediction on Transition 1x (ID)
78.5BLEU ScoreChem4DLLM
Evaluation results
| Method | Links | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Chem4DLLM2026.03 | 78.5 | 58.2 | 1.633 | 80.9 | 76.5 | 67.7 | 99.5 | 0.15 | 0.505 | |
| 4D-MolT52026.03 | 48 | 13.1 | 4.381 | 56.8 | 47.7 | 30.8 | 99 | 0.9 | 1.265 | |
| 3D-MolT52026.03 | 43.1 | 7 | 4.566 | 51.4 | 40 | 24 | 99.2 | 0.902 | 1.392 | |
| 3D-MoLM2026.03 | 21.6 | 7.5 | 10.385 | 29.6 | 25.8 | 16.8 | 51.4 | 3.157 | 3.618 | |
| Chem3D LLM2026.03 | 5.9 | 0 | 8.347 | 20.6 | 12.4 | 5.3 | 95.4 | 1.262 | 2.064 | |
| 4D Text-based2026.03 | 5.1 | 0 | 8.318 | 20 | 11.9 | 4.9 | 95.7 | 1.552 | 2.204 |