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Aligning Target-Aware Molecule Diffusion Models with Exact Energy Optimization

Aligning Target-Aware Molecule Diffusion Models with Exact Energy Optimization

Siyi Gu
Minkai Xu
Alexander Powers
Weili Nie
Tomas Geffner
Karsten Kreis
J. Leskovec
Arash Vahdat
Stefano Ermon
ArXiv (abs)PDFHTML

Papers citing "Aligning Target-Aware Molecule Diffusion Models with Exact Energy Optimization"

2 / 2 papers shown
Title
Reimagining Target-Aware Molecular Generation through Retrieval-Enhanced Aligned Diffusion
Reimagining Target-Aware Molecular Generation through Retrieval-Enhanced Aligned Diffusion
Dong Xu
Zhangfan Yang
Ka-chun Wong
Zexuan Zhu
Jiangqiang Li
Junkai Ji
DiffM
19
0
0
17 Jun 2025
Inference-Time Alignment of Diffusion Models with Evolutionary Algorithms
Inference-Time Alignment of Diffusion Models with Evolutionary Algorithms
Purvish Jajal
Nick Eliopoulos
Benjamin Shiue-Hal Chou
George K. Thiruvathukal
James C. Davis
Yung-Hsiang Lu
22
0
0
30 May 2025

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