Loop motion and base release in purine-specific nucleoside hydrolase: A molecular dynamics study

Nanhao Chen1, Hu Ge1, Jun Xu1, Zexing Cao2, Ruibo Wu1
1School of Pharmaceutical Sciences, Sun Yat-sen University, Guangzhou, 510006, China
2State Key Laboratory of Physical Chemistry of Solid Surfaces and Fujian Provincial Key Laboratory of Theoretical and Computational Chemistry, College of Chemistry and Chemical Engineering, Xiamen University, Xiamen 361005, China

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