Molecular fragment shape variation index for functional groups and the holographic properties of electron density
type: Item
instance of: scholarly article
title: Molecular fragment shape variation index for functional groups and the holographic properties of electron density
zbMATH Open document ID: 1243.92059
author: Paul G. Mezey
publication date: 2012-06-13T00:00:00Z
Mathematics Subject Classification ID: 92E10
Mathematics Subject Classification ID: 92E20
zbMATH DE Number: 6046218
zbMATH Keywords: molecular similarity
zbMATH Keywords: fragment similarity
zbMATH Keywords: holographic electron density theorem
zbMATH Keywords: transition structures
zbMATH Keywords: electronic excited states
zbMATH Keywords: reactivity
zbMATH Keywords: conformational variations
MaRDI profile type: Publication
full work available at URL: s10910-011-9938-9
OpenAlex ID: W2062170476
cites work: A new computational microscope for molecules: High resolution MEDLA images of taxol and HIV-1 protease, using additive electron density fragmentation principles and fuzzy set methods
cites work: Macromolecular density matrices and electron densities with adjustable nuclear geometries
cites work: Q4784581
cites work: The holographic principle for latent molecular properties
DOI: 10.1007/S10910-011-9938-9
published in: Journal of Mathematical Chemistry
description: scientific article; zbMATH DE number 6046218