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Benchmarks
Molecular Property Regression on MoleculeNet HOMO
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0.0022
MAE
BioT5+
-0.007028
0.055261
0.11755
0.179839
Feb 5, 2025
MAE
Updated 4d ago
Evaluation Results
Method
Method
Links
MAE
BioT5+
Model Category=Semi-Ge...
2025.02
0.0022
Mol-LLM (w/o Graph)
Model Category=Generalist
2025.02
0.0044
Mol-LLM
Model Category=Generalist
2025.02
0.0044
InstructMol
Model Category=Specialist
2025.02
0.0048
Mol-Instructions
Model Category=Semi-Ge...
2025.02
0.021
GPT-4
Model Category=General...
2025.02
0.0227
3D-MOLM
Model Category=General...
2025.02
0.0299
ChemDFM
Model Category=General...
2025.02
0.1204
Galactica
Model Category=Generalist
2025.02
0.2329
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