Guo-Bo Li

13 papers Journal 13
YearRankTypeTitle / Venue / Authors
2025 J jnl
A 3D pocket-aware and affinity-guided diffusion model for lead optimization.
CoRR
Anjie Qiao, Junjie Xie, Weifeng Huang, Hao Zhang, Jiahua Rao, Shuangjia Zheng, Yuedong Yang, Zhen Wang, Guo-Bo Li, Jinping Lei
2025 J jnl
A 3D pocket-aware and evolutionary conserved interaction guided diffusion model for molecular optimization.
CoRR
Anjie Qiao, Hao Zhang, Qianmu Yuan, Qirui Deng, Jingtian Su, Weifeng Huang, Huihao Zhou, Guo-Bo Li, Zhen Wang, Jinping Lei
2025 J jnl
A 3D pocket-aware lead optimization model with knowledge guidance and its application for discovery of new glutaminyl cyclase inhibitors.
Briefings Bioinform.
Anjie Qiao, Yuting Chen, Junjie Xie, Weifeng Huang, Hao Zhang, Qirui Deng, Jiahua Rao, Ji Deng, Fanbo Meng, Zhen Wang, Mingyuan Xu, Hongming Chen, Jiancong Xie, Shuangjia Zheng, Yuedong Yang, Guo-Bo Li, Jinping Lei
2025 J jnl
Deciphering Glutaminyl Cyclase Catalytic Pathways Enables Recognition of Anchor Pharmacophores for Inhibitor Discovery.
J. Chem. Inf. Model.
Jing-Wei Wu, Xiang-Li Ning, Biao-Dan Tang, Yi-Ting Chen, Zeng-Bao Yang, Fan-Bo Meng, Cong Zhou, Jun-Lin Yu, Rong Li, Zhe Li, Guo-Bo Li
2025 J jnl
Pharmacophore-oriented 3D molecular generation toward efficient feature-customized drug discovery.
Nat. Comput. Sci.
Jian Peng, Jun-Lin Yu, Zeng-Bao Yang, Yi-Ting Chen, Siqi Wei, Fan-Bo Meng, Yao-Geng Wang, Xiao-Tian Huang, Guo-Bo Li
2025 J jnl
REaMA: Building Biomedical Relation Extraction Specialized Large Language Models Through Instruction Tuning.
IEEE Trans. Neural Networks Learn. Syst.
Yidan Zhang, Junlin Yu, Guo-Bo Li, Zhenan He, Gary G. Yen
2024 J jnl
TarKG: a comprehensive biomedical knowledge graph for target discovery.
Bioinform.
Cong Zhou, Chuipu Cai, Xiao-Tian Huang, Song Wu, Jun-Lin Yu, Jing-Wei Wu, Jiansong Fang, Guo-Bo Li
2023 J jnl
MeDBA: the Metalloenzyme Data Bank and Analysis platform.
Nucleic Acids Res.
Jun-Lin Yu, Song Wu, Cong Zhou, Qing-Qing Dai, Christopher J. Schofield, Guo-Bo Li
2022 J jnl
MeCOM: A Method for Comparing Three-Dimensional Metalloenzyme Active Sites.
J. Chem. Inf. Model.
Gen Li, Qing-Qing Dai, Guo-Bo Li
2020 J jnl
MeLAD: an integrated resource for metalloenzyme-ligand associations.
Bioinform.
Gen Li, Yu Su, Yuhang Yan, Jiayi Peng, Qing-Qing Dai, Xiang-Li Ning, Cheng-Long Zhu, Chen Fu, Michael A. McDonough, Christopher J. Schofield, Cheng Huang, Guo-Bo Li
2017 J jnl
IFPTarget: A Customized Virtual Target Identification Method Based on Protein-Ligand Interaction Fingerprinting Analyses.
J. Chem. Inf. Model.
Guo-Bo Li, Zhu-jun Yu, Sha Liu, Lu-Yi Huang, Ling-Ling Yang, Christopher T. Lohans, Sheng-Yong Yang
2014 J jnl
A prediction model of drug-induced ototoxicity developed by an optimal support vector machine (SVM) method.
Comput. Biol. Medicine
Shu Zhou, Guo-Bo Li, Lu-Yi Huang, Huan-Zhang Xie, Ying-Lan Zhao, Yuzong Chen, Lin-Li Li, Sheng-Yong Yang
2013 J jnl
ID-Score: A New Empirical Scoring Function Based on a Comprehensive Set of Descriptors Related to Protein-Ligand Interactions.
J. Chem. Inf. Model.
Guo-Bo Li, Ling-Ling Yang, Wen-Jing Wang, Lin-Li Li, Sheng-Yong Yang