Dynamic Search for Inference-Time Alignment in Diffusion Models

Fuente: arXiv
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Autores principales: Li, Xiner, Uehara, Masatoshi, Su, Xingyu, Scalia, Gabriele, Biancalani, Tommaso, Regev, Aviv, Levine, Sergey, Ji, Shuiwang
Formato: Preprint
Publicado: 2025
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author Li, Xiner
Uehara, Masatoshi
Su, Xingyu
Scalia, Gabriele
Biancalani, Tommaso
Regev, Aviv
Levine, Sergey
Ji, Shuiwang
author_facet Li, Xiner
Uehara, Masatoshi
Su, Xingyu
Scalia, Gabriele
Biancalani, Tommaso
Regev, Aviv
Levine, Sergey
Ji, Shuiwang
contents Diffusion models have shown promising generative capabilities across diverse domains, yet aligning their outputs with desired reward functions remains a challenge, particularly in cases where reward functions are non-differentiable. Some gradient-free guidance methods have been developed, but they often struggle to achieve optimal inference-time alignment. In this work, we newly frame inference-time alignment in diffusion as a search problem and propose Dynamic Search for Diffusion (DSearch), which subsamples from denoising processes and approximates intermediate node rewards. It also dynamically adjusts beam width and tree expansion to efficiently explore high-reward generations. To refine intermediate decisions, DSearch incorporates adaptive scheduling based on noise levels and a lookahead heuristic function. We validate DSearch across multiple domains, including biological sequence design, molecular optimization, and image generation, demonstrating superior reward optimization compared to existing approaches.
format Preprint
id arxiv_https___arxiv_org_abs_2503_02039
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Dynamic Search for Inference-Time Alignment in Diffusion Models
Li, Xiner
Uehara, Masatoshi
Su, Xingyu
Scalia, Gabriele
Biancalani, Tommaso
Regev, Aviv
Levine, Sergey
Ji, Shuiwang
Machine Learning
Artificial Intelligence
Diffusion models have shown promising generative capabilities across diverse domains, yet aligning their outputs with desired reward functions remains a challenge, particularly in cases where reward functions are non-differentiable. Some gradient-free guidance methods have been developed, but they often struggle to achieve optimal inference-time alignment. In this work, we newly frame inference-time alignment in diffusion as a search problem and propose Dynamic Search for Diffusion (DSearch), which subsamples from denoising processes and approximates intermediate node rewards. It also dynamically adjusts beam width and tree expansion to efficiently explore high-reward generations. To refine intermediate decisions, DSearch incorporates adaptive scheduling based on noise levels and a lookahead heuristic function. We validate DSearch across multiple domains, including biological sequence design, molecular optimization, and image generation, demonstrating superior reward optimization compared to existing approaches.
title Dynamic Search for Inference-Time Alignment in Diffusion Models
topic Machine Learning
Artificial Intelligence
url https://arxiv.org/abs/2503.02039