Analysis of Molecular Dynamics (MD) Simulation of Carbonic Anhydrase

Molecular Dynamics (MD) simulation is a computational method for analyzing the physical movements of atoms and molecules allowed to interact for a fixed duration of time. In this study, the thermal stability of carbonic anhydrase, which catalyzes the reaction of water and carbon dioxide, was investi...

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Bibliographic Details

Published in:	Hungarian materials and chemical sciences and engineering (Online) Vol. 47; no. 1; pp. 109 - 117
Main Authors:	Talei, Saeed, Hadjadj, Rachid, Mizsey, Péter, Owen, Michael C.
Format:	Journal Article
Language:	English
Published:	Miskolc University of Miskolc 05.11.2023
Subjects:	Atoms & subatomic particles Carbon dioxide Carbon sequestration Carbonic anhydrase Cluster analysis Enzymes Hydration Hydrogen bonds Molecular dynamics Proteins Simulation Solvents Temperature Thermal stability
ISSN:	3004-0000, 3004-0817
Online Access:	Get full text
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