Evaluating the covalent binding of carbapenems on BlaC using noncovalent interactions

被引：0
|
作者：
Lu Sun
Hongjun Fan
Shijun Zhong
机构：
[1] Dalian University of Technology,School of Bioengineering
[2] Chinese Academy of Sciences,The State Key Lab of Molecular Reaction Dynamics, Dalian Institute of Chemical Physics (iCheM)
来源：
Journal of Molecular Modeling | 2021年 / 27卷
关键词：
Class A ; -lactamase (BlaC); Covalent carbapenem inhibitor; Molecular dynamics simulation; Binding free energy; Consensus score;
D O I：
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中图分类号：
学科分类号：
摘要：
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