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Molecular Property Optimization on antibacterial like
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90
Normalized Reward
π(·|y*)
27.6
43.8
60
76.2
Apr 16, 2026
Normalized Reward
Updated 1mo ago
Evaluation Results
Method
Method
Links
Normalized Reward
π(·|y*)
2026.04
90
RL
RL training budget=2000
2026.04
84
RL
RL training budget=1000
2026.04
79
Reward Weighted Classifier-Free Guidance (RCFG)
Inference-time samplin...
2026.04
69
Reward Weighted Classifier-Free Guidance (RCFG)
Inference-time samplin...
2026.04
67
Reward Weighted Classifier-Free Guidance (RCFG)
Inference-time samplin...
2026.04
66
Reward Weighted Classifier-Free Guidance (RCFG)
Inference-time samplin...
2026.04
60
RL
RL training budget=500
2026.04
58
Reward Weighted Classifier-Free Guidance (RCFG)
Inference-time samplin...
2026.04
48
Reward Weighted Classifier-Free Guidance (RCFG)
Inference-time samplin...
2026.04
30
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