Book

Computational Chemistry Methods

Name: Computational Chemistry Methods
ISBN: 9783110629064

Applications

Ponnadurai Ramasami

De Gruyter · Print & ebook · August 10, 2020

Reading lane: Physical & Theoretical Chemistry

This book reviews a variety of methods in computational chemistry and their applications in different fields of current research.

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At a Glance

Who It's For

Reading lane: Physical & Theoretical Chemistry and Molecular Modeling.Publisher: De Gruyter.

Book Details

Authors: Ponnadurai Ramasami
Publisher: De Gruyter
Published: August 10, 2020
Format: Print & ebook
Theme: Physical & Theoretical Chemistry · Molecular Modeling
Reading lane: Physical & Theoretical Chemistry

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Publisher Categories

Physical & Theoretical Chemistry
Molecular Modeling
Science
Materials Science

About This Book

This book reviews a variety of methods in computational chemistry and their applications in different fields of current research. Ab initio methods and regression analyses are discussed with special focus on their application to investigate chemical structures as for example dyes or drug compounds. Further topics are the use of computational methods in the modeling of spectroscopic data or to study reaction mechanisms.