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Global and Kinetic Profiles of Substrate Diffusion in Candida antarctica Lipase B: Molecular Dynamics with the Markov-State Model

[Image: see text] Profiling substrate diffusion pathways with kinetic information, which accounts for the dynamic nature of enzyme–substrate interaction, can enable molecular reengineering of enzymes and process optimization of enzymatic catalysis. Candida antarctica lipase B (CALB) is extensively u...

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Bibliografiske detaljer
Udgivet i:ACS Omega
Main Authors: Lu, Chenlin, Peng, Xue, Lu, Diannan, Liu, Zheng
Format: Artigo
Sprog:Inglês
Udgivet: American Chemical Society 2020
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7203684/
https://ncbi.nlm.nih.gov/pubmed/32391467
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.9b04432
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