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Phys. Chem. Chem. Phys., 2025, 27, 8771
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A novel linear indexing method for strings under all internal nodes in a suffix tree

Anas Al-okaily and Abdelghani Tbakhi

Front. Bioinform., 2025, 5
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micRoclean: an R package for decontaminating low-biomass 16S-rRNA microbiome data

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Front. Bioinform., 2025, 5
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AI-Driven Drug Discovery: Focus on Targets for Solid Tumors

Jialong Wu, Jide He, Qianyang Ni, Zi’ang Li, Xiushi Lin, Zhenkun Zhao, Lei Qiu, Hongyin Wang, Sijie Li, Chengdong Shi, Yunyi Zhang, Huile Gao and Jian Lu

Pharmaceutics, 2026, 18, 329
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Accelerating discovery of bioactive ligands with pharmacophore-informed generative models

Weixin Xie, Jianhang Zhang, Qin Xie, Chaojun Gong, Yuhao Ren, Jin Xie, Qi Sun, Youjun Xu, Luhua Lai and Jianfeng Pei

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Tackling the issue of confined chemical space with AI-based de novo drug design and molecular optimization

Alan Talevi, Lucas N. Alberca and Carolina L. Bellera

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Large language models in healthcare and biomedical informatics: A comprehensive review

Andrew Hornback, Harinishree Sathu, Kyungbeom Kim, Yifei Wang, Yuanda Zhu, Monica Isgut, Pavithra Avula, Asma Khimani and May D. Wang

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Exploring Chemical Space with Chemistry-Inspired Dynamic Quantum Circuits in the NISQ Era

Lung-Yi Chen, Tai-Yue Li, Yi-Pei Li, Nan-Yow Chen and Fengqi You

J. Chem. Theory Comput., 2025, 21, 6653
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Large language models in drug development: Current progress and future directions

Anqi Lin, Xiuhui Fang, Aimin Jiang, Chang Qi, Wenyi Gan, Lingxuan Zhu, Weiming Mou, Dongqiang Zeng, Mingjia Xiao, Guangdi Chu, Shengkun Peng, Hank Z.H. Wong, Lin Zhang, Hengguo Zhang, Xinpei Deng, Quan Cheng, Haoran Zhang, Zhuocheng Zhong, Zhengrui Li, Bufu Tang and Peng Luo

Current Molecular Pharmacology, 2025, 18, 1
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Advancements in Large Language Models (LLMs): Empowering Drug Discovery

Bosheng Song, Xiaowen Li, Xiuxiu Chao, Li Wang, Yiping Liu, Zhen Xia, Dongsheng Cao and Xiangzheng Fu

WIREs Comput Mol Sci, 2025, 15
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Large Model Era: Deep Learning in Osteoporosis Drug Discovery

Junlin Xu, Xiaobo Wen, Li Sun, Kunyue Xing, Linyuan Xue, Sha Zhou, Jiayi Hu, Zhijuan Ai, Qian Kong, Zishu Wen, Li Guo, Minglu Hao and Dongming Xing

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Discovery of Novel Natural Product-Based PDE4 Inhibitors for Ischemic Stroke Treatment without Emetogenicity at Ultra-High Doses

Chuang Xia, Mingjia Yu, Yujie Ni, Shanfang Fang, Kaiwen Feng, Tingting Zhang, Chunping Gu, Kaibin Huang and Zhong-Zhen Zhou

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Application and Prospects of Large Language Models in Small-Molecule Drug Discovery

Jin Ma, Jia Liu, Dongyu Xu, Xiaoyu Song and Zhichang Zhang

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A hybrid graph attention model for drug-disease association prediction using graph embeddings techniques

Tintu Vijayan and Pamela Vinitha Eric

J Ambient Intell Human Comput, 2025, 16, 861
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