Single-property molecular optimization on DRD2
98.1SRSFT-LLM_Mistral
Evaluation results
| Method | Links | |||
|---|---|---|---|---|
| SFT-LLM_MistralBackbone=Mistral, Protocol=SFT2026.04 | 98.1 | 57 | 8.66 | |
| DPO-LLM_LLaMABackbone=LLaMA, Protocol=DPO2026.04 | 97.8 | 55 | 10.63 | |
| SFT-LLM_LLaMABackbone=LLaMA, Protocol=SFT2026.04 | 96.6 | 58 | 7.76 | |
| DPO-LLM_MistralBackbone=Mistral, Protocol=DPO2026.04 | 95.6 | 55 | 14.82 | |
| LLaMAshots=52026.04 | 71.4 | 15 | 15.08 | |
| LlaSmol_Mistral2026.04 | 63.6 | 30 | 0.18 | |
| GPT-4oshots=52026.04 | 33.4 | 62 | 1.93 | |
| Mistralshots=52026.04 | 28.6 | 64 | 1.92 | |
| Claude-3.5shots=52026.04 | 28.2 | 69 | 1.63 | |
| GPT-4oshots=02026.04 | 19 | 73 | 0.25 | |
| Mistralshots=02026.04 | 17.6 | 72 | 0.72 | |
| Claude-3.5shots=02026.04 | 15.4 | 73 | 0.79 | |
| LLaMAshots=02026.04 | 12.8 | 70 | 0.02 | |
| ChemLLM2026.04 | 12.8 | 80 | 0.01 |