Molecular Property Prediction on QED (test)
0.0547RMSEMolT5-large
Evaluation Results
| Method | Links | |
|---|---|---|
| MolT5-largeArchitecture=Encoder-Decoder2026.07 | 0.0547 | |
| MolT5-baseArchitecture=Encoder-Decoder2026.07 | 0.0646 | |
| Qwen3-0.6BArchitecture=Decoder-Only2026.07 | 0.0656 | |
| Qwen3-1.7BArchitecture=Decoder-Only2026.07 | 0.066 | |
| BioT5-baseArchitecture=Encoder-Decoder2026.07 | 0.0713 | |
| MolT5-smallArchitecture=Encoder-Decoder2026.07 | 0.0804 | |
| Galactica-125MArchitecture=Decoder-Only2026.07 | 0.0915 | |
| Qwen3-4BArchitecture=Decoder-Only2026.07 | 0.0925 | |
| LLaMA-3.2-1BGED perturbation level (k)=Raw, Fine-tuning protocol=standard fine-tuning2026.07 | 0.1302 | |
| LLaMA-3.2-1BArchitecture=Decoder-Only2026.07 | 0.1302 | |
| LLaMA-3.2-1BGED perturbation level (k)=k=1, Fine-tuning protocol=standard fine-tuning2026.07 | 0.16 | |
| LLaMA-3.2-1BGED perturbation level (k)=k=2, Fine-tuning protocol=standard fine-tuning2026.07 | 0.1733 | |
| LLaMA-3.2-1BGED perturbation level (k)=k=3, Fine-tuning protocol=standard fine-tuning2026.07 | 0.1857 | |
| ChemLLM-7BGED perturbation level (k)=k=2, Fine-tuning protocol=standard fine-tuning2026.07 | 0.1957 | |
| LLaMA-3.2-1BGED perturbation level (k)=k=4, Fine-tuning protocol=standard fine-tuning2026.07 | 0.1999 | |
| LLaMA-3.2-1BGED perturbation level (k)=k=5, Fine-tuning protocol=standard fine-tuning2026.07 | 0.2119 | |
| ChemLLM-7BGED perturbation level (k)=k=1, Fine-tuning protocol=standard fine-tuning2026.07 | 0.2456 | |
| ChemLLM-7BGED perturbation level (k)=k=5, Fine-tuning protocol=standard fine-tuning2026.07 | 0.2457 | |
| ChemLLM-7BGED perturbation level (k)=Raw, Fine-tuning protocol=standard fine-tuning2026.07 | 0.2677 | |
| ChemLLM-7BArchitecture=Decoder-Only2026.07 | 0.2677 | |
| ChemLLM-7BGED perturbation level (k)=k=4, Fine-tuning protocol=standard fine-tuning2026.07 | 0.2788 | |
| ChemLLM-7BGED perturbation level (k)=k=3, Fine-tuning protocol=standard fine-tuning2026.07 | 0.2936 |