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Molecular Property Prediction on MoleculeNet BBBP

90AccuracyChemToolAgent
54.6463.827382.18May 27, 2025

Evaluation results

MethodLinks
ChemToolAgentzero-shot=true2025.0590
ChemAmp (Stage 1+2)zero-shot=true2025.0568
Deepseek-R1zero-shot=true2025.0561
ChemCrowzero-shot=true2025.0560
Llama3-70Bzero-shot=true2025.0559
ChemAmp (Stage 1)zero-shot=true2025.0559
Uni-Mol-v2zero-shot=true2025.0558
ChemDFM-13Bzero-shot=true2025.0557
GPT-4ozero-shot=true2025.0556