Computational techniques have advanced in chemical and biological fields, enabling greater understanding of spectral data. This work provides a definitive overview of the field, drawing on recent advances and established theory. It highlights the innovative and wide-ranging breakthroughs made by leaders in computational spectrum prediction and the application of computational methodologies to analytical science. Format: Hardback Length: 366 pages Publication date: 24 November 2020 Publisher: Royal Society of Chemistry Computational techniques have advanced significantly in chemical and biological fields, enabling greater understanding of data through advanced detection limits and technological innovation. This has led to the development of robust and reliable analytical methodologies, both experimentally and theoretically, allowing chemists and biologists to access spectral data with excellent accuracy. This comprehensive work will serve as a definitive overview of the field of computational simulation in analytical chemistry and biology, drawing on recent advances and established theory. Computational approaches provide additional depth to biochemical problems and offer alternative explanations to atomic-scale phenomena. The book highlights innovative and wide-ranging breakthroughs made by leaders in computational spectrum prediction and the application of computational methodologies to analytical science. Contributed chapters originate from a group of internationally recognized leaders in the field, each applying computational techniques to develop our understanding of and supplement the data obtained from experimental analytical science. This book is an essential resource for graduates and postgraduate researchers, demonstrating how computational analytical methods have become accessible across disciplines. Weight: 728g Dimension: 163 x 240 x 30 (mm) ISBN-13: 9781788014618
