CORDIS Project
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This research investigates the quantum mechanics of protein behavior, focusing on biocatalysis and receptor activation. By simulating proton dynamics in specific proteins, the project aims to uncover insights relevant to enzyme functionality and drug design, particularly for conditions like Parkinson's disease.
The main purpose of this computational research is to improve the understanding of biocatalysis and receptor triggering by studying the quantum nature of nuclear motion in proteins.
Specifically, the research will be focused on three particular biological systems:
Soybean lipoxygenase (SLO–1), Monoamine oxidase B (MAO B) and histamine H2 receptor (hisH2).
The proposed studies will be devoted to the simulation of proton dynamics and proton transfer in systems containing short H–bonds, which are a…
KEMIJSKI INSTITUT
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