论文 - 实验室网站

#1 2021

Discovery of Natural Products Targeting NQO1 via an Approach Combining Network-Based Inference and Identification of Privileged Substructures

作者: Zengrui Wu, Qiaohui Wang, Hongbin Yang, Jiye Wang, Weihua Li, Guixia Liu, Yi Yang, Yuzheng Zhao*, Yun Tang*

期刊: J. Chem. Inf. Model.

信息: 2021 | 61(5) | 2486-2498

#2 2021

Pathway-Based Drug Repurposing with DPNetinfer: A Method to Predict Drug–Pathway Associations via Network-Based Approaches

作者: Jiye Wang, Zengrui Wu, Yayuan Peng, Weihua Li, Guixia Liu, Yun Tang*

期刊: J. Chem. Inf. Model.

信息: 2021 | 61(5) | 2475-2485

#3 2021

Homotropic Cooperativity of Midazolam Metabolism by Cytochrome P450 3A4: Insight from Computational Studies

作者: Junhao Li, Yue Chen, Yun Tang, Weihua Li*, Yaoquan Tu*

期刊: J. Chem. Inf. Model.

信息: 2021 | 61(5) | 2418-2426

#4 2021

Twin drug design, synthesis and evaluation of diosgenin derivatives as multitargeted agents for the treatment of vascular dementia

作者: Guixiang Yang, Jiamin Sun, Lulu Zheng, Li Zhang, Jie Li, Haixian Gan, Yan Huang, Jin Huang, Xingxing Diao, Yun Tang*, Rui Wang*, Lei Ma*

期刊: Bioorg. Med. Chem.

信息: 2021 | Vol.37 | 116109

#5 2021

Assessment of CYP2C9 Structural Models for Site of Metabolism Prediction

作者: Xiaoxiao Zhang, Minjie Xu, Zengrui Wu, Guixia Liu, Yun Tang, Weihua Li*

期刊: ChemMedChem

信息: 2021 | Vol.DOI | 10

#6 2021

In silico prediction of chemical respiratory toxicity via machine learning

作者: Zhiyuan Wang, Piaopiao Zhao, Xiaoxiao Zhang, Xuan Xu, Weihua Li, Guixia Liu, Yun Tang*

期刊: Comput. Toxicol.

信息: 2021 | Vol.18 | 100155

#7 2021

In silico prediction of mitochondrial toxicity of chemicals using machine learning methods

作者: Piaopiao Zhao, Yayuan Peng, Xuan Xu, Zhiyuan Wang, Zengrui Wu, Weihua Li, Yun Tang*, Guixia Liu*

期刊: J. Appl. Toxicol.

信息: 2021 | Vol.DOI | 10

#8 2021

In silico prediction of chemical acute contact toxicity on honey bees via machine learning methods

作者: Xuan Xu, Piaopiao Zhao, Zhiyuan Wang, Xiaoxiao Zhang, Zengrui Wu, Weihua Li, Yun Tang*, Guixia Liu*

期刊: Toxicol. In Vitro

信息: 2021 | Vol.72 | 105089

#9 2021

Insights into the Molecular Mechanisms of Liuwei Dihuang Decoction via Network Pharmacology

作者: Jianhui Chen, Dan Teng, Zengrui Wu, Weihua Li, Yuqian Feng, Yun Tang*, Guixia Liu*

期刊: Chem. Res. Toxicol.

信息: 2021 | 34(1) | 91-102

发表论文

2021

Discovery of Natural Products Targeting NQO1 via an Approach Combining Network-Based Inference and Identification of Privileged Substructures

Pathway-Based Drug Repurposing with DPNetinfer: A Method to Predict Drug–Pathway Associations via Network-Based Approaches

Homotropic Cooperativity of Midazolam Metabolism by Cytochrome P450 3A4: Insight from Computational Studies

Twin drug design, synthesis and evaluation of diosgenin derivatives as multitargeted agents for the treatment of vascular dementia

Assessment of CYP2C9 Structural Models for Site of Metabolism Prediction

In silico prediction of chemical respiratory toxicity via machine learning

In silico prediction of mitochondrial toxicity of chemicals using machine learning methods

In silico prediction of chemical acute contact toxicity on honey bees via machine learning methods

Insights into the Molecular Mechanisms of Liuwei Dihuang Decoction via Network Pharmacology

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