Wei Wei Xue (Weiwei Xue)

ResearcherID Loop profile ORCID

Publication Activity (10 Years)

Years Active: 2016-2024
Publications (10 Years): 38

Top Venues

Journal of chemical information and modeling

ACS chemical neuroscience

Nucleic acids research

Chemical biology & drug design

Chongqing University

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Chongqing University Jun 25 2014

China

Associate Professor :: School of Pharmaceutical Sciences and Innovative Drug Research Centre

Publications

Xiaojie Jin, Min Zhang, Beibei Fu, Mi Li, Jingyi Yang, Zhiming Zhang, Chenghao Li, Huijuan Zhang, Haibo Wu, Wei Wei Xue, Yongqi Liu
Structure-Based Discovery of the SARS-CoV-2 Main Protease Noncovalent Inhibitors from Traditional Chinese Medicine. Journal of chemical information and modeling 64 (4) (2024)
Xiaojie Jin, Min Zhang, Beibei Fu, Mi Li, Jingyi Yang, Zhiming Zhang, Chenghao Li, Huijuan Zhang, Haibo Wu, Wei Wei Xue, Yongqi Liu
Structure-Based Discovery of the SARS-CoV-2 Main Protease Noncovalent Inhibitors from Traditional Chinese Medicine. Journal of chemical information and modeling 64 (4) (2024)
Kerui Chen, Li Luo, Gao Tu, Jingyi Yang, Wang Pu, Junyu Zhu, Wei Wei Xue, Rui Zhang
Computer-aided discovery of novel aryl hydrocarbon receptor ligands to regulate CYP1A1 expression in inflammatory macrophages. Chemical biology & drug design 103 (6) (2024)
Xiaona Wang, Yintao Zhang, Zengpeng Li, Zixin Duan, Menghan Guo, Zhen Wang, Jian Zhang, Wei Wei Xue
PROSCA: an online platform for humanized scaffold mining facilitating rational protein engineering. Nucleic acids research 52 (W1) (2024)
Xiaona Wang, Yintao Zhang, Zengpeng Li, Zixin Duan, Menghan Guo, Zhen Wang, Jian Zhang, Wei Wei Xue
PROSCA: an online platform for humanized scaffold mining facilitating rational protein engineering. Nucleic acids research 52 (W1) (2024)
Yao Wu, Bin Li, Linkun Ying, Yao Chen, Yuxin Zhang, Chaoming Hu, Yichi Zhang, Lele Yi, Wei Wei Xue, Shengbin Huang, Zengqiang Song
Design, Synthesis, and Biological Evaluation of β-Trifluoroethoxydimethyl Selenides as Potent Antiosteoporosis Agents. Journal of medicinal chemistry 67 (9) (2024)
Kerui Chen, Li Luo, Gao Tu, Jingyi Yang, Wang Pu, Junyu Zhu, Wei Wei Xue, Rui Zhang
Computer-aided discovery of novel aryl hydrocarbon receptor ligands to regulate CYP1A1 expression in inflammatory macrophages. Chemical biology & drug design 103 (6) (2024)
Ding Luo, Yang Zhang, Yinghong Li, Zerong Liu, Haibo Wu, Wei Wei Xue
Structural Models of Human Norepinephrine Transporter Ensemble Reveal the Allosteric Sites and Ligand-Binding Mechanism. The journal of physical chemistry. B (2024)
Rongpei Gou, Jingyi Yang, Menghan Guo, Yingjun Chen, Wei Wei Xue
CNSMolGen: A Bidirectional Recurrent Neural Network-Based Generative Model for De Novo Central Nervous System Drug Design. Journal of chemical information and modeling (2024)
Shiyang Zhou, Wei Wei Xue, Jun Tan
Design, Synthesis, and Antirheumatoid Arthritis Mechanism of TLR4 Inhibitors. ACS omega 9 (34) (2024)
Xiaojie Jin, Min Zhang, Beibei Fu, Mi Li, Jingyi Yang, Zhiming Zhang, Chenghao Li, Huijuan Zhang, Haibo Wu, Wei Wei Xue, Yongqi Liu
Structure-Based Discovery of the SARS-CoV-2 Main Protease Noncovalent Inhibitors from Traditional Chinese Medicine. Journal of chemical information and modeling 64 (4) (2024)
Gao Tu, Tingting Fu, Guoxun Zheng, Binbin Xu, Rongpei Gou, Ding Luo, Panpan Wang, Wei Wei Xue
Computational Chemistry in Structure-Based Solute Carrier Transporter Drug Design: Recent Advances and Future Perspectives. Journal of chemical information and modeling (2024)
Gao Tu, Tingting Fu, Guoxun Zheng, Binbin Xu, Rongpei Gou, Ding Luo, Panpan Wang, Wei Wei Xue
Computational Chemistry in Structure-Based Solute Carrier Transporter Drug Design: Recent Advances and Future Perspectives. Journal of chemical information and modeling 64 (5) (2024)
Shiyang Zhou, Wei Wei Xue, Jun Tan
Design, Synthesis, and Antirheumatoid Arthritis Mechanism of TLR4 Inhibitors. ACS omega 9 (34) (2024)
Yao Wu, Bin Li, Linkun Ying, Yao Chen, Yuxin Zhang, Chaoming Hu, Yichi Zhang, Lele Yi, Wei Wei Xue, Shengbin Huang, Zengqiang Song
Design, Synthesis, and Biological Evaluation of β-Trifluoroethoxydimethyl Selenides as Potent Antiosteoporosis Agents. Journal of medicinal chemistry (2024)
Gao Tu, Tingting Fu, Guoxun Zheng, Binbin Xu, Rongpei Gou, Ding Luo, Panpan Wang, Wei Wei Xue
Computational Chemistry in Structure-Based Solute Carrier Transporter Drug Design: Recent Advances and Future Perspectives. Journal of chemical information and modeling 64 (5) (2024)
Xiaona Wang, Yintao Zhang, Zengpeng Li, Zixin Duan, Menghan Guo, Zhen Wang, Jian Zhang, Wei Wei Xue
PROSCA: an online platform for humanized scaffold mining facilitating rational protein engineering. Nucleic acids research (2024)
Lingyan Zheng, Shuiyang Shi, Xiuna Sun, Mingkun Lu, Yang Liao, Sisi Zhu, Hongning Zhang, Ziqi Pan, Pan Fang, Zhenyu Zeng, Honglin Li, Zhaorong Li, Wei Wei Xue, Jian Zhang
MoDAFold: a strategy for predicting the structure of missense mutant protein based on AlphaFold2 and molecular dynamics. Briefings in bioinformatics 25 (2) (2024)
Xiaojie Jin, Min Zhang, Beibei Fu, Mi Li, Jingyi Yang, Zhiming Zhang, Chenghao Li, Huijuan Zhang, Haibo Wu, Wei Wei Xue, Yongqi Liu
Structure-Based Discovery of the SARS-CoV-2 Main Protease Noncovalent Inhibitors from Traditional Chinese Medicine. Journal of chemical information and modeling (2024)
Rongpei Gou, Jingyi Yang, Menghan Guo, Yingjun Chen, Wei Wei Xue
CNSMolGen: A Bidirectional Recurrent Neural Network-Based Generative Model for De Novo Central Nervous System Drug Design. Journal of chemical information and modeling 64 (10) (2024)
Gao Tu, Tingting Fu, Guoxun Zheng, Binbin Xu, Rongpei Gou, Ding Luo, Panpan Wang, Wei Wei Xue
Computational Chemistry in Structure-Based Solute Carrier Transporter Drug Design: Recent Advances and Future Perspectives. Journal of chemical information and modeling 64 (5) (2024)
Gao Tu, Binbin Xu, Ding Luo, Jin Liu, Zerong Liu, Gang Chen, Wei Wei Xue
Multi-state Model-Based Identification of Cryptic Allosteric Sites on Human Serotonin Transporter. ACS chemical neuroscience (2023)
Shengzhe Deng, Haiwei Zhang, Rongpei Gou, Ding Luo, Zerong Liu, Jian Zhang, Wei Wei Xue
Structure-Based Discovery of a Novel Allosteric Inhibitor against Human Dopamine Transporter. Journal of chemical information and modeling (2023)
Beibei Fu, Yan Xiong, Zhou Sha, Wei Wei Xue, Binbin Xu, Shun Tan, Dong Guo, Feng Lin, Lulu Wang, Jianjian Ji, Yang Luo, Xiaoyuan Lin, Haibo Wu
SEPTIN2 suppresses an IFN-γ-independent, proinflammatory macrophage activation pathway. Nature communications 14 (1) (2023)
Wei Wei Xue, Tingting Fu, Shengzhe Deng, Fengyuan Yang, Jingyi Yang, Jian Zhang
Molecular Mechanism for the Allosteric Inhibition of the Human Serotonin Transporter by Antidepressant Escitalopram. ACS chemical neuroscience 13 (3) (2022)
Linfei Zhao, Mingliang Chen, Xiaona Wang, Shoukai Kang, Wei Wei Xue, Zengpeng Li
Identification of Anti-TNFα VNAR Single Domain Antibodies from Whitespotted Bambooshark ( Chiloscyllium plagiosum ). Marine drugs 20 (5) (2022)
Xiaona Wang, Fengcheng Li, Wenqi Qiu, Binbin Xu, Yanlin Li, Xichen Lian, Hongyan Yu, Zhao Zhang, Jianxin Wang, Zhaorong Li, Wei Wei Xue, Jian Zhang
SYNBIP: synthetic binding proteins for research, diagnosis and therapy. Nucleic acids research (2021)
Jing Jing, Gao Tu, Hongyan Yu, Rong Huang, Xianquan Ming, Haiqing Zhan, Feng Zhan, Wei Wei Xue
Copper (Cu2+) ion-induced misfolding of tau protein R3 peptide revealed by enhanced molecular dynamics simulation. Physical chemistry chemical physics : PCCP 23 (20) (2021)
Jingyi Yang, Xiaoyuan Lin, Na Xing, Zhao Zhang, Haiwei Zhang, Haibo Wu, Wei Wei Xue
Structure-Based Discovery of Novel Nonpeptide Inhibitors Targeting SARS-CoV-2 Mpro. Journal of chemical information and modeling 61 (8) (2021)
Gao Tu, Tingting Fu, Fengyuan Yang, Jingyi Yang, Zhao Zhang, Xiao-Jun Yao, Wei Wei Xue, Jian Zhang
Understanding the Polypharmacological Profiles of Triple Reuptake Inhibitors by Molecular Simulation. ACS chemical neuroscience 12 (11) (2021)
Jingyi Yang, Zhao Zhang, Fengyuan Yang, Haiwei Zhang, Haibo Wu, Jian Zhang, Wei Wei Xue
Computational design and modeling of nanobodies toward SARS-CoV-2 receptor binding domain. Chemical biology & drug design 98 (1) (2021)
Yang Zhang, Jun Biao Ying, Jia Jun Hong, Feng Cheng Li, Ting Ting Fu, Feng Yuan Yang, Guo Xun Zheng, Xiao Jun Yao, Yan Lou, Yunqing Qiu, Wei Wei Xue, Jian Zhang
How Does Chirality Determine the Selective Inhibition of Histone Deacetylase 6? A Lesson from Trichostatin A Enantiomers Based on Molecular Dynamics. ACS chemical neuroscience 10 (5) (2019)
Qingxia Yang, Yunxia Wang, Song Zhang, Jing Tang, Fengcheng Li, Jiayi Yin, Yi Li, Jianbo Fu, Bo Li, Yongchao Luo, Wei Wei Xue, Jian Zhang
Biomarker Discovery for Immunotherapy of Pituitary Adenomas: Enhanced Robustness and Prediction Ability by Modern Computational Tools. International journal of molecular sciences 20 (1) (2019)
Gao Tu, Tingting Fu, Fengyuan Yang, Lixia Yao, Wei Wei Xue, Jian Zhang
Prediction of GluN2B-CT1290-1310/DAPK1 Interaction by Protein⁻Peptide Docking and Molecular Dynamics Simulation. Molecules (Basel, Switzerland) 23 (11) (2018)
Wei Wei Xue, Fengyuan Yang, Panpan Wang, Guoxun Zheng, Yuzong Chen, Xiao-Jun Yao, Jian Zhang
What Contributes to Serotonin-Norepinephrine Reuptake Inhibitors' Dual-Targeting Mechanism? The Key Role of Transmembrane Domain 6 in Human Serotonin and Norepinephrine Transporters Revealed by Molecular Dynamics Simulation. ACS chemical neuroscience 9 (5) (2018)
Tingting Fu, Guoxun Zheng, Gao Tu, Fengyuan Yang, Yu Zong Chen, Xiao-Jun Yao, Xiaofeng Li, Wei Wei Xue, Jian Zhang
Exploring the Binding Mechanism of Metabotropic Glutamate Receptor 5 Negative Allosteric Modulators in Clinical Trials by Molecular Dynamics Simulations. ACS chemical neuroscience 9 (6) (2018)
Panpan Wang, Xiaoyu Zhang, Tingting Fu, Shuang Li, Bo Li, Wei Wei Xue, Xiaojun Yao, Yuzong Chen, Jian Zhang
Differentiating Physicochemical Properties between Addictive and Nonaddictive ADHD Drugs Revealed by Molecular Dynamics Simulation Studies. ACS chemical neuroscience 8 (6) (2017)
Jingyu Xu, Panpan Wang, Hong Yang, Jin Zhou, Yinghong Li, Xiaoxu Li, Wei Wei Xue, Chunyan Yu, Yubin Tian, Feng Zhu
Comparison of FDA Approved Kinase Targets to Clinical Trial Ones: Insights from Their System Profiles and Drug-Target Interaction Networks. BioMed research international 2016 (2016)

Wei Wei Xue.css-eqlu8i{font-size:small;padding-left:4px;} (Weiwei Xue)

Publication Activity (10 Years)

Top Topics

Top Venues

Wei Wei Xue (Weiwei Xue)