Design of nanobody-based bispecific constructs by in silico affinity maturation and umbrella sampling simulations

Design of nanobody-based bispecific constructs by in silico affinity maturation and umbrella sampling simulations

Random mutagenesis is the natural opportunity for proteins to evolve and biotechnologically it has been exploited to create diversity and identify variants with improved characteristics in the mutant pools. Rational mutagenesis based on biophysical assumptions and supported by computational power ha...

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Bibliographic Details
Main Authors: Zixuan Bai, Jiewen Wang, Jiaqi Li, Haibin Yuan, Ping Wang, Miao Zhang, Yuanhang Feng, Xiangtong Cao, Xiangan Cao, Guangbo Kang, Ario de Marco, He Huang
Format: Article
Language:English
Published: Elsevier 2023-01-01
Series:Computational and Structural Biotechnology Journal
Subjects:
Bispecific construct
Rational affinity maturation
Umbrella sampling simulation
TNF-α
IL-23
Online Access:http://www.sciencedirect.com/science/article/pii/S2001037022005785

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http://www.sciencedirect.com/science/article/pii/S2001037022005785

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