Search Result "Electron density topological analysis"


General Research Article

Topological Analysis of Electron Density in Large Biomolecular Systems

Journal: Current Drug Discovery Technologies
Volume: 16 Issue: 4 Year: 2019 Page: 437-448
Author(s): Maria A. Grishina,Vladimir A. Potemkin

Describing the Molecular Mechanism of Organic Reactions by Using Topological Analysis of Electronic Localization Function

Journal: Current Organic Chemistry
Volume: 15 Issue: 2 Year: 2011 Page: 3566-3575
Author(s): J. Andres, S. Berski, L. R. Domingo, V. Polo, B. Silvi

Molecular Electron Density Theory: A New Theoretical Outlook on Organic Chemistry

Ebook: Frontiers in Computational Chemistry
Volume: 5 Year: 2020
Author(s): Luis R. Domingo,Nivedita Acharjee
Doi: 10.2174/9789811457791120050007

Electron-Topological Method of the Non-Nucleoside HIV-1 RT Inhibitors Study: Structure-Activity Relationships

Journal: Current HIV Research
Volume: 5 Issue: 5 Year: 2007 Page: 449-458
Author(s): Fatma Kandemirli, Vasyl Kovalishyn, Sedat Giray Kandemirli

Research Article

Molecular Docking, Topological Analysis and Vibrational Studies on N-(2-Bromoethyl) Succinimide: Antidepressant Agent

Journal: Letters in Organic Chemistry
Volume: 18 Issue: 10 Year: 2021 Page: 797-811
Author(s): Aslı Eşme

Letter Article

NMR and FT-IR Investigation Study and Topological Analysis of VariousConformations of 2,5-dimethyl-2,5-dihydroxyl-1,4-dithian using Density FunctionalTheory Method

Journal: Current Organic Chemistry
Volume: 27 Issue: 13 Year: 2023 Page: 1123-1131
Author(s):

Electronic-Topological Study of Structurally Diverse Cyclooxygenase-2 Inhibitors

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 3 Issue: 4 Year: 2003 Page: 281-294
Author(s): A. Dimoglo, E. Sim, N. Shvets, V. Ahsen

Structural and Electronic Factors Influencing the Selective Inhibition of COX-2

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 16 Issue: 7 Year: 2016 Page: 579-594
Author(s): Fatma Aksakal,Natali Shvets,Veronika Khairullina,Anatholy Dimoglo

Structural, Chemical Topological, Electrotopological and Electronic Structure Hypotheses

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 6 Issue: 8 Year: 2003 Page: 801-809
Author(s): F. Torrens

QSAR Modeling of Carcinogenic Risk Using Discriminant Analysis and Topological Molecular Descriptors

Journal: Current Drug Discovery Technologies
Volume: 2 Issue: 2 Year: 2005 Page: 55-67
Author(s): Joseph F. Contrera, Philip MacLaughlin, Lowell H. Hall, Lemont B. Kier

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