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Molecule Generation on Molecule Design

12,433Modes (R > 7.5)CMAB-GFN (CA)
1,494.284,334.147,17410,013.86Feb 12, 2026

Evaluation results

MethodLinks
CMAB-GFN (CA)Training Round=10^5, Time (s / 100 rounds)=28.732026.0212,4332,5208.2950
CMAB-GFNTraining Round=10^5, Time (s / 100 rounds)=27.952026.0212,0892,9528.3149
TB-GFNTraining Round=10^5, Time (s / 100 rounds)=24.372026.021,9152338.0147