Computational identification of potential chemoprophylactic agents according to dynamic behavior of peroxisome proliferator-activated receptor gamma

Author:

Yang Zhiwei12345ORCID,Zhao Yizhen12345,Hao Dongxiao12345ORCID,Wang He12345,Li Shengqing67895,Jia Lintao101112135,Yuan Xiaohui1415165,Zhang Lei12345,Meng Lingjie117345ORCID,Zhang Shengli12345

Affiliation:

1. MOE Key Laboratory for Nonequilibrium Synthesis and Modulation of Condensed Matter

2. School of Physics

3. Xi'an Jiaotong University

4. Xi'an 710049

5. China

6. Department of Pulmonary and Critical Care Medicine

7. Huashan Hospital

8. Fudan University

9. Shanghai 200041

10. State Key Laboratory of Cancer Biology

11. Department of Biochemistry and Molecular Biology

12. Air Force Medical University

13. Xi'an 710032

14. Institute of Biomedicine

15. Jinan University

16. Guangzhou 510632

17. School of Chemistry

Abstract

Offering a new strategy for resurrecting PPARγ-targeted therapeutics to chemoprevention, by taking the conformational plasticity of the receptor into account in the virtual screening procedure.

Funder

National Natural Science Foundation of China

Fundamental Research Funds for the Central Universities

China Postdoctoral Science Foundation

Shaanxi Province Postdoctoral Science Foundation

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

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