Machine Learning and Pattern Recognition Methods in Chemistry from Multivariate and Data Driven Modeling

Author:   Jahan B. Ghasemi (Faculty of Chemistry, University of Tehran, Tehran, Iran)
Publisher:   Elsevier - Health Sciences Division
ISBN:  

9780323904087


Pages:   216
Publication Date:   20 October 2022
Format:   Paperback
Availability:   Manufactured on demand   Availability explained
We will order this item for you from a manufactured on demand supplier.

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Machine Learning and Pattern Recognition Methods in Chemistry from Multivariate and Data Driven Modeling


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Overview

Machine Learning and Pattern Recognition Methods in Chemistry from Multivariate and Data Driven Modeling outlines key knowledge in this area, combining critical introductory approaches with the latest advanced techniques. Beginning with an introduction of univariate and multivariate statistical analysis, the book then explores multivariate calibration and validation methods. Soft modeling in chemical data analysis, hyperspectral data analysis, and autoencoder applications in analytical chemistry are then discussed, providing useful examples of the techniques in chemistry applications. Drawing on the knowledge of a global team of researchers, this book will be a helpful guide for chemists interested in developing their skills in multivariate data and error analysis.

Full Product Details

Author:   Jahan B. Ghasemi (Faculty of Chemistry, University of Tehran, Tehran, Iran)
Publisher:   Elsevier - Health Sciences Division
Imprint:   Elsevier - Health Sciences Division
Weight:   0.450kg
ISBN:  

9780323904087


ISBN 10:   0323904084
Pages:   216
Publication Date:   20 October 2022
Audience:   Professional and scholarly ,  Professional & Vocational
Format:   Paperback
Publisher's Status:   Active
Availability:   Manufactured on demand   Availability explained
We will order this item for you from a manufactured on demand supplier.

Table of Contents

1. Statistical Methods in Chemical Data Analysis 2. Multivariate Predictive Modeling and Validation 3. Multivariate Pattern Recognition by Machine Learning Methods 4. Tuning the Apparent Thermodynamic Parameters of Chemical Systems 5. The Analytical/Measurement Sources of Multivariate Errors 6. Autoencoders in Analytical Chemistry 7. Uniqueness in Resolving Multivariate Chemical Data Appendix 1. Introduction to Python

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Author Information

Dr. Jahan B Ghasemi received his PhD from Shiraz University. He was a visiting Scientist at the University of Chalmers in 2001 and Delaware University in 2006. His current research interests are focused on chemometrics and data analysis and computational drug design. He is the author of more than 200 papers and 4 chapter books in international journals and books.

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