Article
Replica-exchange optimization of antibody fragments.
Computational biology and chemistry - 1 Apr 2023
Soler Miguel A, Minovski Nikola, Rocchia Walter, Fortuna Sara
Abstract excerpt
In the framework of the rational design of macromolecules capable of binding to a specific target for biosensing applications, we here further develop an evolutionary protocol designed to optimize the binding affinity of protein binders. In particular we focus on the optimization of the binding portion of small antibody fragments known as nanobodies (or VHH) and choose the hen egg white lysozyme (HEWL) as our...
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