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#1 2013

Computational insights into the binding modes of Sr-Rex with cofactor NADH/NAD+ and operator DNA

作者: Yanyan Chu, Weihua Li, Jianfeng Wang, Guixia Liu, Yun Tang*

期刊: J. Mol. Model.

信息: 2013 | 19(8) | 3143-3151

#2 2013

Design, synthesis and biological evaluation of organophosphorous-homodimers as dual binding site acetylcholinesterase inhibitors

作者: Ruliang Xie, Qianfei Zhao, Tao Zhang, Jing Fang , Xiangdong Mei, Jun Ning*, Yun Tang*

期刊: Bioorg. Med. Chem.

信息: 2013 | 21(1) | 278-282

#3 2013

Catalytic Mechanism of Cytochrome P450 2D6 for 4-Hydroxylation of Aripiprazole: A QM/MM Study

作者: Rongwei Shi, Weihua Li, Guixia Liu, Yun Tang*

期刊: Chinese J. Chem.

信息: 2013 | 31(9) | 1219-1227

#4 2013

The role of benzoic acid in proline-catalyzed asymmetric michael addition: A density functional theory study

作者: Hongwei Shi, Xiangui Huang, Guixia Liu*, Kunqian Yu, Congying Xu, Weihua Li, Bubing Zeng*, Yun Tang*

期刊: Int. J. Quantum. Chem.

信息: 2013 | 113(9) | 1339-1348

#5 2013

Prediction of Polypharmacological Profiles of Drugs by the Integration of Chemical, Side Effects and Therapeutic Space

作者: Feixiong Cheng, Weihua Li, Zengrui Wu, Xichuan Wang, Chen Zhang, Jie Li, Guixia Liu and Yun Tang

期刊: J. Chem. Inf. Model.

信息: 2013 | 53(4) | 753-762

#6 2013

Lee, Yun Tang*

作者: Feixiong Cheng, Weihua Li, Yadi Zhou, Jie Li, Jie Shen, Philip W

期刊: Prediction of Human Genes and Diseases Targeted by Xenobiotics Using Predictive Toxicogenomics-Derived Models (PTDMs). Mol. BioSyst

信息: 2013 | 9(6) | 1316-1325

#7 2013

Adverse Drug Events: Database Construction and In Silico Prediction

作者: Feixiong Cheng, Weihua Li, Xichuan Wang, Yadi Zhou, Zengrui Wu, Jie Shen and Yun Tang

期刊: J. Chem. Inf. Model.

信息: 2013 | 53(4) | 744-752

#8 2013

In Silico ADMET Prediction: Recent Advances, Current Challenges and Future Trends

作者: Feixiong Cheng, Weihua Li, Guixia Liu, Yun Tang*

期刊: Curr Top Med Chem

信息: 2013 | 13(11) | 1273-1289

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2013