Jump to main content
Jump to site search
Book cover

Computational Techniques for Analytical Chemistry and Bioanalysis Editors: Philippe B Wilson, Martin Grootveld



Buy hardback £169.00 *
Add to pick and choose £507.00
* Exclusive of taxes
This book contains 366 pages.

Publication details


Print publication date
10 Dec 2020
Copyright year
2021
Print ISBN
978-1-78801-461-8
PDF eISBN
978-1-78801-588-2
ePub eISBN
978-1-78801-985-9

About this book

As analysis, in terms of detection limits and technological innovation, in chemical and biological fields has developed so computational techniques have advanced enabling greater understanding of the data. Indeed, it is now possible to simulate spectral data to an excellent level of accuracy, allowing chemists and biologists access to robust and reliable analytical methodologies both experimentally and theoretically.

This work will serve as a definitive overview of the field of computational simulation as applied to analytical chemistry and biology, drawing on recent advances as well as describing essential, established theory. Computational approaches provide additional depth to biochemical problems, as well as offering alternative explanations to atomic scale phenomena. Highlighting the innovative and wide-ranging breakthroughs made by leaders in computational spectrum prediction and the application of computational methodologies to analytical science, this book is for graduates and postgraduate researchers showing how computational analytical methods have become accessible across disciplines. Contributed chapters originate from a group of internationally-recognised leaders in the field, each applying computational techniques to develop our understanding of and supplement the data obtained from experimental analytical science.