Search Result "Electron Density"


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

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

The Essence of Density Functional Theory

Ebook: DFT Based Studies on Bioactive Molecules
Volume: 1 Year: 2021
Author(s): Ambrish Kumar Srivastava,Neeraj Misra
Doi: 10.2174/9789814998369121010003

Review Article

Electronic Structure of Linear Polyacenes

Journal: Current Organic Chemistry
Volume: 21 Issue: 27 Year: 2017 Page: 2768-2775
Author(s): Fanica Cimpoesu,Cristina Buta,Marilena Ferbinteanu,Michael R. Philpott,Alessandro Stroppa,Mihai V. Putz

Quantum Systems of Electrons in a Semiconductor Crystal

Ebook: Open Quantum Physics and Environmental Heat Conversion into Usable Energy
Volume: 2 Year: 2017
Author(s): Eliade Stefanescu
Doi: 10.2174/9781681084190117020004

Intra-Molecular Electron Transfer in Proteins

Journal: Protein & Peptide Letters
Volume: 15 Issue: 6 Year: 2008 Page: 556-561
Author(s): Thomas Brittain

Conceptual Density Functional Theory of Chemical Reactivity

Ebook: Advances in Mathematical Chemistry and Applications
Volume: 1 Year: 2014
Author(s): Pratim K. Chattaraj,Debesh R. Roy
Doi: 10.2174/9781608059287114010013

The Use of Density Functional Theory in Computer-Aided Drug Discovery

Ebook: Computer-Aided Drug Discovery Methods: A Brief Introduction
Volume: 1 Year: 2024
Author(s): Manos C. Vlasiou
Doi: 10.2174/9789815305036124010006

Perspective

Electron Communications and Correlations in Subsystems

Journal: Current Physical Chemistry
Volume: 12 Issue: 2 Year: 2022 Page: 95-116
Author(s): Roman F. Nalewajski

Bond Ellipticity as a Measure of Electron Delocalization in Structure and Reactivity

Journal: Current Organic Chemistry
Volume: 15 Issue: 2 Year: 2011 Page: 3576-3593
Author(s): Carlos Silva Lopez, Angel R. de Lera

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