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Aligning Target-Aware Molecule Diffusion Models with Exact Energy
  Optimization

Aligning Target-Aware Molecule Diffusion Models with Exact Energy Optimization

1 July 2024
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
1