Applied Chemometrics for Scientists
by Brereton, Richard G.Edition: 1st
Format: Hardcover
Pub. Date: 2007-04-02
Publisher(s): WILEY
Other versions by this Author
List Price: $142.02
Buy New
Usually Ships in 8 - 10 Business Days.
$135.26
Rent Textbook
Select for Price
Digital
$126.00*
Used Textbook
We're Sorry
Sold Out
How Marketplace Works:
- This item is offered by an independent seller and not shipped from our warehouse
- Item details like edition and cover design may differ from our description; see seller's comments before ordering.
- Sellers much confirm and ship within two business days; otherwise, the order will be cancelled and refunded.
- Marketplace purchases cannot be returned to eCampus.com. Contact the seller directly for inquiries; if no response within two days, contact customer service.
- Additional shipping costs apply to Marketplace purchases. Review shipping costs at checkout.
Summary
The book introduces most of the basic tools of chemometrics including experimental design, signal analysis, statistical methods for analytical chemistry and multivariate methods. It then discusses a number of important applications including food chemistry, biological pattern recognition, reaction monitoring, optimisation of processes, medical applications. The book arises from a series of short articles that have been developed over four years on Chemweb (www.chemweb.com).
Author Biography
Richard G. Brereton, 1979-1983 : University of Cambridge, 1983 - : University of Bristol, current position Professor and Director of the Centre of Chemometrics, B.A., (Hons) 1976 (Natural Sciences, speciality chemistry; University of Cambridge), M.A., 1980 (University of Cambridge), Ph.D., 1981 (Thesis : Spectroscopic Studies of Bacteriochlorophyll a; supervisor : Prof. J.K.M.Sanders, FRS, Chemical Laboratory, University of Cambridge), MRSC, C.Chem., 1991 (Royal Society of Chemistry)
Over 1250 citations in the literature, 60+ invited lectures, 30+ seminars given, 2 authored books, contributed to 9 edited works and has co-edited 3 books. Served as Associate Editor Chemometrics and Intelligent Laboratory Systems (Elsevier) for 5 years.
Taught in undergraduate and graduate courses for over 20 years, written extensively in the application of Chemometrics.
Table of Contents
| Preface | |
| Introduction | |
| Development of Chemometrics | |
| Application Areas | |
| How to Use this Book | |
| Literature and Other Sources of Information | |
| References | |
| Experimental Design | |
| Why Design Experiments in Chemistry? | |
| Degrees of Freedom and Sources of Error | |
| Analysis of Variance and Interpretation of Errors | |
| Matrices, Vectors and the Pseudoinverse | |
| Design Matrices | |
| Factorial Designs | |
| An Example of a Factorial Design | |
| Fractional Factorial Designs | |
| Plackett-Burman and Taguchi Designs | |
| The Application of a Plackett-Burman Design to the Screening of Factors Influencing a Chemical Reaction | |
| Central Composite Designs | |
| Mixture Designs | |
| A Four Component Mixture Design Used to Study Blending of Olive Oils | |
| Simplex Optimization | |
| Leverage and Confidence in Models | |
| Designs for Multivariate Calibration | |
| References | |
| Statistical Concepts | |
| Statistics for Chemists | |
| Errors | |
| Describing Data | |
| The Normal Distribution | |
| Is a Distribution Normal? | |
| Hypothesis Tests | |
| Comparison of Means: the t-Test | |
| F-Test for Comparison of Variances | |
| Confidence in Linear Regression | |
| More about Confidence | |
| Consequences of Outliers and How to Deal with Them | |
| Detection of Outliers | |
| Shewhart Charts | |
| More about Control Charts | |
| References | |
| Sequential Methods | |
| Sequential Data | |
| Correlograms | |
| Linear Smoothing Functions and Filters | |
| Fourier Transforms | |
| Maximum Entropy and Bayesian Methods | |
| Fourier Filters | |
| Peakshapes in Chromatography and Spectroscopy | |
| Derivatives in Spectroscopy and Chromatography | |
| Wavelets | |
| References | |
| Pattern Recognition | |
| Introduction | |
| Principal Components Analysis | |
| Graphical Representation of Scores and Loadings | |
| Comparing Multivariate Patterns | |
| Preprocessing | |
| Unsupervised Pattern Recognition: Cluster Analysis | |
| Supervised Pattern Recognition | |
| Statistical Classification Techniques | |
| K Nearest Neighbour Method | |
| How Many Components Characterize a Dataset? | |
| Multiway Pattern Recognition | |
| References | |
| Calibration | |
| Introduction | |
| Univariate Calibration | |
| Multivariate Calibration and the Spectroscopy of Mixtures | |
| Multiple Linear Regression | |
| Principal Components Regression | |
| Partial Least Squares | |
| How Good is the Calibration and What is the Most Appropriate Model? | |
| Multiway Calibration | |
| References | |
| Coupled Chromatography | |
| Introduction | |
| Preparing the Data | |
| Chemical Composition of Sequential Data | |
| Univariate Purity Curves | |
| Similarity Based Methods | |
| Evolving and Window Factor Analysis | |
| Derivative Based Methods | |
| Deconvolution of Evolutionary Signals | |
| Noniterative Methods for Resolution | |
| Iterative Methods for Resolution | |
| Equilibria, Reactions and Process Analytics | |
| The Study of Equilibria using Spectroscopy | |
| Spectroscopic Monitoring of Reactions | |
| Kinetics and Multivariate Models for the Quantitative Study of Reactions | |
| Developments in the Analysis of Reactions using On-line Spectroscopy | |
| The Process Analytical Technology Initiative | |
| References | |
| Table of Contents provided by Publisher. All Rights Reserved. |
An electronic version of this book is available through VitalSource.
This book is viewable on PC, Mac, iPhone, iPad, iPod Touch, and most smartphones.
By purchasing, you will be able to view this book online, as well as download it, for the chosen number of days.
Digital License
You are licensing a digital product for a set duration. Durations are set forth in the product description, with "Lifetime" typically meaning five (5) years of online access and permanent download to a supported device. All licenses are non-transferable.
More details can be found here.
A downloadable version of this book is available through the eCampus Reader or compatible Adobe readers.
Applications are available on iOS, Android, PC, Mac, and Windows Mobile platforms.
Please view the compatibility matrix prior to purchase.