About admetSAR

References
  1. Defang Fan, Hongbin Yang, Fuxing Li, Lixia Sun, Peiwen Di, Weihua Li, Yun Tang*, Guixia Liu*. In silico prediction of chemical genotoxicity using machine learning methods and structural alerts. Toxicol. Res., 2018,7, 211-220.
  2. Lixia Sun, Hongbin Yang, Jie Li, Tianduanyi Wang, Weihua Li, Guixia Liu, Yun Tang*. In Silico Prediction of Compounds Binding to Human Plasma Proteins by QSAR Models. ChemMedChem 2017, 12,1–11.
  3. Hongbin Yang, Xiao Li, Yingchun Cai, Qin Wang, Weihua Li, Guixia Liu, Yun Tang*. In silico Prediction of Chemical Subcellular Localization via Multi-classification Methods. Med. Chem. Commun., 2017,8, 1225-1234.
  4. Qin Wang, Xiao Li, Hongbin Yang, Yingchun Cai, Yinyin Wang, Zhuang Wang, Weihua Li, Yun Tang*, Guixia Liu*. In silico prediction of serious eye irritation or corrosion potential of chemicals. RSC Adv., 2017, 7(11): 6697-6703.
  5. Fuxing Li, Defang Fan, Hao Wang, Hongbin Yang, Weihua Li, Yun Tang*, Guixia Liu*. In Silico Prediction of Pesticide Aquatic Toxicity with Chemical Category Approaches. Toxicol. Res. 2017, 6(6), 831–842.
  6. Chen Zhang, Yuan Zhou, Shikai Gu, Zengrui Wu, Wenjie Wu, Changming Liu, Kaidong Wang, Guixia Liu, Weihua Li, Philip W. Lee, Yun Tang*. In silico prediction of hERG potassium channel blockage by chemical category approaches. Toxicol. Res., 2016, 5(2): 570-582.
  7. Xiao Li, Zheng Du, Jie Wang, Zengrui Wu, Weihua Li, Guixia Liu, Xu Shen, Yun Tang*. In Silico Estimation of Chemical Carcinogenicity with Binary and Ternary Classification Methods. Mol. Inform., 2015, 34: 228-235.
  8. Chen Zhang, Feixiong Cheng, Lu Sun, Shulin Zhuang, Weihua Li, Guixia Liu, Philip W. Lee*, Yun Tang*. In silico prediction of chemical toxicity on avian species using chemical category approaches. Chemosphere, 2015, 122: 280-287.
  9. Xiao Li, Lei Chen, Feixiong Cheng, Zengrui Wu, Hanping Bian, Congying Xu, Weihua Li, Guixia Liu, Xu Shen, Yun Tang*. In Silico Prediction of Chemical Acute Oral Toxicity Using Multi-Classification Methods. J. Chem. Inf. Model., 2014, 54(4): 1061-1069.
  10. Congying Xu, Feixiong Cheng, Lei Chen, Zheng Du, Weihua Li, Guixia Liu, Philip W. Lee, and Yun Tang. In Silico Prediction of Chemical Ames Mutagenicity. J. Chem. Inf. Model., 2012, 52(11): 2840-2847. (This paper is the 3th most assessed article of JCIM in Oct. 2012).
  11. Feixiong Cheng, Yutaka Ikenaga, Yadi Zhou, Yue Yu, Weihua Li, Jie Shen, Zheng Du, Lei Chen, Congyin Xu, Guixia Liu, Philip W. Lee* and Yun Tang*. In Silico Assessment of Chemical Biodegradability. J. Chem. Inf. Model., 2012, 52(11): 2840-2847. (This paper is the 4th most assessed article of JCIM in Oct. 2012).
  12. Feixiong Cheng, Yue Yu, Yadi Zhou, Zhonghua Shen, Wen Xiao, Guixia Liu, Weihua Li*, Philip W. Lee and Yun Tang*. Insights into Molecular Basis of Cytochrome P450 Inhibitory Promiscuity of Compounds. J. Chem. Inf. Model., 2012, 52(11): 2840-2847. (This paper is the 3th most assessed article of JCIM in Oct. 2012).
  13. Feixiong Cheng, Yue Yu, Jie Shen, Lei Yang, Weihua Li*, Guixia Liu, Philip W. Lee and Yun Tang*. Classification of Cytochrome P450 Inhibitors and non-Inhibitors using Combined Classifiers. J. Chem. Inf. Model., 2012, 52(11): 2840-2847. (This paper is the 5th most assessed article of JCIM in Oct. 2012).
  14. Feixiong Cheng, Jie Shen, Yue Yu, Weihua Li*, Guixia Liu, Philip W. Lee and Yun Tang*. In silico prediction of Tetrahymena pyriformis toxicity for diverse industrial chemicals with substructure pattern recognition and machine learning methods. Chemosphere, 2011, 82(11): 1636-1643.
  15. Jie Shen, Feixiong Cheng, You Xu, Weihua Li* and Yun Tang*. Estimation of ADME Properties with Substructure Pattern Recognition, J. Chem. Inf. Model., 2010, 50, 1034-041.

Contact us

Hongbin Yang, PhD Candidate

Maintainer
School of Pharmacy, East China University of Science and Technology.
130 Meilong Road, Shanghai 200237, China
Email: yanyanghong(at)163.com

Prof. Yun Tang

Principal investigator
School of Pharmacy, East China University of Science and Technology.
130 Meilong Road, Shanghai 200237, China
Tel: +86-21-64251052
Email: ytang234(at)ecust.edu.cn

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