Defines Conditional Distribution Matching (CDM) as finding inputs whose induced conditional distributions match a target distribution and proposes the MLGD-F inference-time algorithm using pretrained diffusion models to solve it without retraining.
Inverse molecular design using machine learning: Generative models for matter engineering.Science, 361(6400):360–365
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Inverse Design for Conditional Distribution Matching
Defines Conditional Distribution Matching (CDM) as finding inputs whose induced conditional distributions match a target distribution and proposes the MLGD-F inference-time algorithm using pretrained diffusion models to solve it without retraining.