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Revealing the Positive Binding Cooperativity Mechanism between the Orthosteric and the Allosteric Antagonists of CCR2 by Metadynamics and Gaussian Accelerated Molecular Dynamics Simulations

  • Xiaoli An
  • , Qifeng Bai
  • , Zhitong Bing
  • , Hongli Liu
  • , Qianqian Zhang
  • , Huanxiang Liu
  • , Xiaojun Yao
  • Lanzhou University
  • CAS - Institute of Modern Physics
  • Macau University of Science and Technology

Research output: Contribution to journalArticlepeer-review

13 Citations (Scopus)

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Biochemistry, Genetics and Molecular Biology