Drug-resistance mechanisms of three mutations in anaplastic lymphoma kinase against two inhibitors based on MM/PBSA combined with interaction entropy-Reference-Cited by-同舟云学术

Drug-resistance mechanisms of three mutations in anaplastic lymphoma kinase against two inhibitors based on MM/PBSA combined with interaction entropy

Published:2019 Issue:37 Volume:21 Page:20951-20964
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Xiao Zhengrong¹²³⁴,Cong Yalong⁵⁶⁷⁸⁴,Huang Kaifang¹²³⁴,Zhong Susu¹²³⁴,Zhang John Z. H.⁵⁶⁷⁸⁴^ORCID,Duan Lili¹²³⁴^ORCID

Affiliation:

1. School of Physics and Electronics

2. Shandong Normal University

3. Jinan

4. China

5. Shanghai Engineering Research Center of Molecular Therapeutics and New Drug Development

6. School of Chemistry and Molecular Engineering

7. East China Normal University

8. Shanghai

Abstract

As a promising drug target in the treatment of lung cancer, anaplastic lymphoma kinase (ALK) and its mutations have been studied widely. This work explored the origin of the resistance mechanism of the ALK mutants again two inhibitors.

Funder

National Natural Science Foundation of China

Natural Science Foundation of Shandong Province

Shanghai Municipal Education Commission

New York University

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2019/CP/C9CP02851J

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