Efficient screening and discovery of umami peptides in Douchi enhanced by molecular dynamics simulations

Efficient screening and discovery of umami peptides in Douchi enhanced by molecular dynamics simulations

In this study, a partial least squares discriminant analysis (PLS-DA) discriminant model for umami peptides was constructed based on molecular dynamics simulation data, achieving a R2 value of 0.949 and a Q2 value of 0.558. Using this novel model and bioinformatics screening methods, five new umami...

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Bibliographic Details
Main Authors: Weidan Guo, Kangzi Ren, Zhao Long, Xiangjin Fu, Jianan Zhang, Min Liu, Yaquan Chen
Format: Article
Language:English
Published: Elsevier 2024-12-01
Series:Food Chemistry: X
Subjects:
Douchi
Peptidomics
Molecular docking
Molecular dynamics simulation
Umami peptide
Online Access:http://www.sciencedirect.com/science/article/pii/S2590157524008289
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