Classical molecular dynamics and metadynamics simulations decipher the mechanism of CBP30 selectively inhibiting

Qianqian Wang1, Xiaoli An, Jiahui Xu

  • 1State Key Laboratory of Quality Research in Chinese Medicine/Macau Institute for Applied Research in Medicine and Health, Macau University of Science and Technology, Taipa, Macau, China. lliu@must.edu.mo lhleung@must.edu.mo xjyao@must.edu.mo.

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