Regression on ESOL
0.52RMSELLM4SD
Evaluation results
| Method | Links | |
|---|---|---|
| LLM4SD2025.12 | 0.52 | |
| TokenMol2025.12 | 0.593 | |
| ChemATPBackbone=DeepSeek-V3.22025.12 | 0.6504 | |
| CoTBackbone=DeepSeek-V3.2, Few-Shot=false2025.12 | 0.8944 | |
| CoT+FSBackbone=DeepSeek-V3.2, Few-Shot=true2025.12 | 0.9134 | |
| DABackbone=DeepSeek-V3.2, Few-Shot=false2025.12 | 1.0194 | |
| DA+FSBackbone=DeepSeek-V3.2, Few-Shot=true2025.12 | 1.0497 | |
| MoleculeSTM2025.12 | 1.177 | |
| MolRAG2025.12 | 3.2806 |