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Comparative Computational Approach To Study Enzyme Reactions Using QM and QM-MM Methods

[Image: see text] Choline oxidase catalyzes oxidation of choline into glycine betaine through a two-step reaction pathway employing flavin as the cofactor. On the light of kinetic studies, it is proposed that a hydride ion is transferred from α-carbon of choline/hydrated-betaine aldehyde to the N5 p...

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Xehetasun bibliografikoak
Argitaratua izan da:ACS Omega
Egile Nagusiak: Yildiz, Ibrahim, Yildiz, Banu Sizirici, Kirmizialtin, Serdal
Formatua: Artigo
Hizkuntza:Inglês
Argitaratua: American Chemical Society 2018
Sarrera elektronikoa:https://ncbi.nlm.nih.gov/pmc/articles/PMC6643517/
https://ncbi.nlm.nih.gov/pubmed/31458147
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.8b02638
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