Functional-Group-Based Diffusion for Pocket-Specific Molecule Generation
and Elaboration

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Functional-Group-Based Diffusion for Pocket-Specific Molecule Generation and Elaboration

30 May 2023

Lirong Wu

Siyuan Li

Stan Z. Li

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Papers citing "Functional-Group-Based Diffusion for Pocket-Specific Molecule Generation and Elaboration"

6 / 6 papers shown

Title
Reimagining Target-Aware Molecular Generation through Retrieval-Enhanced Aligned Diffusion Dong Xu Zhangfan Yang Ka-chun Wong Zexuan Zhu Jiangqiang Li Junkai Ji DiffM 40 0 0 17 Jun 2025
Tokenizing Electron Cloud in Protein-Ligand Interaction Learning H. Lin Odin Zhang Jia Xu Yunfan Liu Zheng Cheng Lirong Wu Yufei Huang Zhifeng Gao Stan Z. Li 53 0 0 25 May 2025
Piloting Structure-Based Drug Design via Modality-Specific Optimal Schedule Keyue Qiu Yuxuan Song Zhehuan Fan Peidong Liu Zheng Zhang Mingyue Zheng Hao Zhou Wei-Ying Ma 91 0 0 12 May 2025
What Ails Generative Structure-based Drug Design: Expressivity is Too Little or Too Much? Rafał Karczewski Samuel Kaski Markus Heinonen Vikas Garg 134 0 0 12 Aug 2024
Learning to Predict Mutation Effects of Protein-Protein Interactions by Microenvironment-aware Hierarchical Prompt Learning Lirong Wu Yijun Tian Haitao Lin Yufei Huang Siyuan Li Nitesh Chawla Stan Z. Li 79 6 0 16 May 2024
MAPE-PPI: Towards Effective and Efficient Protein-Protein Interaction Prediction via Microenvironment-Aware Protein Embedding Lirong Wu Yijun Tian Yufei Huang Siyuan Li Haitao Lin Nitesh Chawla Stan Z. Li 81 24 0 22 Feb 2024