Molecular Property Regression on MoleculeNet LUMO
0.0024MAEBioT5+
Evaluation results
| Method | Links | |
|---|---|---|
| BioT5+Model Category=Semi-Generalist, Training Task Group=Reg. & React., Official Checkpoint=true2025.02 | 0.0024 | |
| Mol-LLM (w/o Graph)Model Category=Generalist2025.02 | 0.0043 | |
| Mol-LLMModel Category=Generalist2025.02 | 0.0043 | |
| InstructMolModel Category=Specialist2025.02 | 0.005 | |
| Mol-InstructionsModel Category=Semi-Generalist, Official Checkpoint=true2025.02 | 0.021 | |
| GalacticaModel Category=Generalist2025.02 | 0.0413 | |
| GPT-4Model Category=Generalist, Evaluation Setup=5-shot2025.02 | 0.0462 | |
| 3D-MOLMModel Category=Generalist, Official Checkpoint=true2025.02 | 0.0536 | |
| ChemDFMModel Category=Generalist, Official Checkpoint=true2025.02 | 0.1262 |