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Reference type: Journal
Authors: Bani-Khaled GFH, Muzyka KM
Article Title: Method of molecular mechanics in the rationale choice of functional monomers specific to vancomycin.
Publication date: 2017
Journal: Information Processing Systems
Volume: 1(147)
Page numbers: 152-154.
Alternative URL: http://www.hups.mil.gov.ua/periodic-app/article/17305/eng

Abstract: The method of molecular mechanics studied molecular structure and interaction energy systems "functional monomer:template" in a vacuum. As functional monomers reviewed twenty five monomers with different properties. Vancomycin was used as a template. It is shown that in a vacuum is the most energetically favorable vancomycin complexes with functional monomers, ethylene glycol methacrylate phosphate, N, N- methylene-bis-acrylamide, methacrylamide. These results justify the selection of the best candidate monomer to create a molecular imprinted polymer vancomycin.
Template and target information: vancomycin
Author keywords: molecular mechanics, computer simulation, molecular imprinting, Vancomycin, complexation


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