Search Result "ELF TOPOLOGICAL CONCEPTS"


Basic Concepts and Applications of Molecular Topology to Drug Design

Ebook: Advances in Mathematical Chemistry and Applications Volume 1 (Revised Edition)
Volume: 1 Year: 2015
Author(s): Jorge Gálvez,María Gálvez-Llompart,Ramón García-Domenech
Doi: 10.2174/9781681081977115010012

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

Understanding the Bond Formation in Hetero-Diels-Alder Reactions. An ELF Analysis of the Reaction of Nitroethylene with Dimethylvinylamine

Journal: Current Organic Chemistry
Volume: 16 Issue: 1 Year: 2012 Page: 2343-2351
Author(s): Luis R. Domingo, Patricia Perez, M. Jose Aurell, Jose A. Saez

Understanding the High Reactivity of the Azomethine Ylides in [3 + 2] Cycloaddition Reactions

Journal: Letters in Organic Chemistry
Volume: 7 Issue: 6 Year: 2010 Page: 432-439
Author(s): Luis R. Domingo, Eduardo Chamorro, Patricia Perez

Electron Localization Function as a Measure of Electron Delocalization and Aromaticity

Journal: Current Organic Chemistry
Volume: 15 Issue: 2 Year: 2011 Page: 3619-3626
Author(s): Patricio Fuentealba, Juan C. Santos

On the Relation Between Residue Flexibility and Residue Interactions in Proteins

Journal: Protein & Peptide Letters
Volume: 18 Issue: 5 Year: 2011 Page: 450-456
Author(s): Hui Yin, Yi-Zhou Li, Meng-Long Li

Localization and Localizability in Quantum Organic Chemistry: Localized Orbitals and Localization Functions

Journal: Current Organic Chemistry
Volume: 15 Issue: 2 Year: 2011 Page: 3555-3565
Author(s): Bernard Silvi, Peter Reinhardt

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

Role of Transmembrane Domain/Transmembrane Domain Interfaces of PGlycoprotein (ABCB1) in Solute Transport. Convergent Information from Photoaffinity Labeling, Site Directed Mutagenesis and in Silico Importance Prediction

Journal: Current Medicinal Chemistry
Volume: 13 Issue: 7 Year: 2006 Page: 793-805
Author(s): Peter Chiba, Ivana Mihalek, Gerhard F. Ecker, Stephan Kopp, Olivier Lichtarge

Review Article

Chemo-drug Controlled-release Strategies of Nanocarrier in the Development of Cancer Therapeutics

Journal: Current Medicinal Chemistry
Volume: 28 Issue: 31 Year: 2021 Page: 6307-6322
Author(s): Yunyi Liu,Hailong Ou,Xiaming Pei,Bin Jiang,Yihan Ma,Naiyu Liu,Chaoqi Wen,Cheng Peng,Xiaoxiao Hu

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