Theoretical and computational chemistry aspects
Chemical sciences in the focus ;, v. 3./ edited by Ponnadurai Ramasami.

Ramasami Ponnadurai

Главная
→
EBSCO eBook (только для КФУ)
→
Полнотекстовая коллекция книг EBSCO eBook
→
Просмотр элемента

dc.contributor.author	Ramasami Ponnadurai
dc.date.accessioned	2024-01-29T23:35:44Z
dc.date.available	2024-01-29T23:35:44Z
dc.date.issued	2021
dc.identifier.citation	Theoretical and computational chemistry aspects Chemical sciences in the focus ;, v. 3. - 1 online resource - URL: https://libweb.kpfu.ru/ebsco/pdf/3050103.pdf
dc.identifier.isbn	9783110739763
dc.identifier.isbn	3110739763
dc.identifier.isbn	9783110739800
dc.identifier.isbn	3110739801
dc.identifier.uri	https://dspace.kpfu.ru/xmlui/handle/net/182481
dc.description.abstract	Based on "The Virtual Conference on Chemistry and its Applications (VCCA-2020) - Research and Innovations in Chemical Sciences: Paving the Way Forward" held in August 2020 and organized by the Computational Chemistry Group of the University of Mauritius. The chapters reflect a wide range of fundamental and applied research in the chemical sciences and interdisciplinary subjects.
dc.description.tableofcontents	1 Role of heteroatoms and substituents on the structure, reactivity, aromaticity, and absorption spectra of pyrene: a density functional theory study -- 2 Effect of delocalization of nonbonding electron density on the stability of the M-Ccarbene bond in main group metalimidazol- 2-ylidene complexes: a computational and structural database study -- 3 Educational components in the supervision of chemistry postgraduate students: experiences and reflections -- 4 Chemometric exploratory data analysis for patients with diabetes type 2 and diabetic complications -- 5 Electronic structure theory study of the reactivity and structural molecular properties of halo-substituted (F, Cl, Br) and heteroatom (N, O, S) doped cyclobutane -- 6 Theoretical investigation of the stability, reactivity, and the interaction of methylsubstituted peridinium-based ionic liquids -- 7 Chemical computational approaches for optimization of effective surfactants in enhanced oil recovery -- 8 Determination of bulk and surface properties of liquid Bi-Sn alloys using an improved quasi-lattice theory -- 9 Identification of potential histone deacetylase inhibitory biflavonoids from Garcinia kola (Guttiferae) using in silico protein-ligand interaction -- 10 Thermodynamics of the micellization of quaternary based cationic surfactants in triethanolamine-water media: a conductometry study
dc.language	English
dc.language.iso	en
dc.relation.ispartofseries	Chemical sciences in the focus. volume 3
dc.relation.ispartofseries	Chemical sciences in the focus ;. v. 3.
dc.subject.other	Chemistry, Physical and theoretical.
dc.subject.other	Computational chemistry.
dc.subject.other	Electronic books.
dc.title	Theoretical and computational chemistry aspects Chemical sciences in the focus ;, v. 3./ edited by Ponnadurai Ramasami.
dc.type	Book
dc.contributor.org	Virtual Conference on Chemistry and its Applications "Research and Innovations in Chemical Sciences: Paving the Way Forward"
dc.description.pages	1 online resource
dc.collection	Электронно-библиотечные системы
dc.source.id	EN05CEBSCO05C4675