DSpace About DSpace Software DSpace
 

Repository KhNMU >
Кафедри >
Кафедра медичної та біоорганічної хімії >
Наукові праці. Кафедра медичної та біоорганічної хімії >

Please use this identifier to cite or link to this item: http://repo.knmu.edu.ua/handle/123456789/15993

Название: Investigation of Quantum-chemical Properties of Acetylsalicylic Acid
Авторы: Syrovaya, Anna Olegovna
Kozub, Svetlana Nikolaevna
Tishakova, Tatyana Stanislavovna
Levashova, Olga Leonidovna
Chalenko, Natalya Nikolaevna
Ключевые слова: Acetylsalicylic acid
Molecular orbitals
Dipole moment
Issue Date: 2017
Издатель: Scholars Research Library
Библиографическое описание: Investigation of Quantum-chemical Properties of Acetylsalicylic Acid / A. O. Syrovaya, S. N. Kozub, T. S. Tishakova, O. L. Levashova, N. N. Chalenko // Der Pharma Chemica. – 2017. – № 9 (6). – P. 11–14.
Аннотация: Quantum chemistry provides a physical insight into the sequences of processes that are the basis of drug action related to the pharmacokinetic and pharmacodynamics’ phases. The results of computation of such quantum-chemical parameters of acetylsalicylic acid as geometrical structure, atomic charges, high occupied and low unoccupied molecular orbital energies, electrostatic potential, total charge density, etc. were analyzed. Installed quantum-chemical properties of acetylsalicylic acid are the basis of the molecular mechanisms of its pharmacological action.
URI: http://repo.knmu.edu.ua/handle/123456789/15993
Appears in Collections:Наукові праці. Кафедра медичної та біоорганічної хімії

Files in This Item:

File Description SizeFormat
acetylsalicylic acid.pdf234,48 kBAdobe PDFView/Open


This item is protected by original copyright

View Statistics

Items in DSpace are protected by copyright, with all rights reserved, unless otherwise indicated.

 

Valid XHTML 1.0! DSpace Software Copyright © 2002-2010  Duraspace - Feedback