Paul Gemperline 4/16/2006 Search this book Builds upon fundamental concepts to reach advanced topics in chemometrics, providing a starting point for beginners and a reference for experts Offers numerous examples, including 26 worked examples using MATLAB?/sup> code, to illustrate how easily these techniques can be adapted to various experimental scenarios Refers to public and commercial software packages that are easily acquired to work the examples in the book for themselves when appropriate Describes the use of SIMCA, Pirouette, GRAMS/32, PLS Toolbox, Unscrambler, and DX6 computer tools Includes summary, solutions to problems, recommended reading, and key references for the applications and methods introduced in each chapter
The limited coverage of data analysis and statistics offered in most undergraduate and graduate analytical chemistry courses is usually focused on practical aspects of univariate methods. Drawing in real-world examples,Practical Guide to Chemometrics, SecondEditionoffers an accessible introduction to application-oriented multivariate methods of data analysis and procedures that are highly beneficial to solving a variety of problems using analytical chemistry and statistics.
Rather than overshadowing the concepts with theoretical background, this book uses application-oriented examples to illustrate how chemometrics techniques can be applied to complex scenarios with multiple and dynamic variables. The book presents a diverse selection of topics that include sampling, modeling, experimental design, calibration, pattern recognition, data analysis techniques, algorithms, and error. This second edition has been completely revised to feature new chapters on principal component analysis, self-modeling curve resolution, and multi-way analysis methods. It includes expanded material on normal distributions, sampling theory, signal processing, and digital filtering.
Embracing the growing role of chemometrics in some of the latest research trends, such as quantitative biology, bioinformatics, and proteomics, this book also identifies several areas for future development and applications.Practical Guide to Chemometrics, Second Editioncontinues to offer a reliable source of useful information in a style. that is accessible to all levels of students, professionals, and researchers involved in analyzing scientific data.
Search this book Table of Contents Introduction to Chemometrics;P.J. Gemperline Statistical Evaluation of Data;A. D. Walmsley Sampling Theory, Distribution Functions, and the Multivariate Normal Distribution;P.J. Gemperline and J.H. Kalivas Principal Component Analysis;P.J. Gemperline Calibration;J.H. Kalivas and P.J. Gemperline Robust Calibration;M. Hubert Kinetic Modeling of Multivariate Measurements with Nonlinear Regression;M.?Maeder and Yorck-Michael Neuhold Response-Surface Modeling and Experimental Design;K. Stoyanov and A.D. Walmsley Classification and Pattern Recognition;B.K. Lavine and C.E. Davidson Signal Processing and Digital Filtering;S.D. Brown Multivariate Curve Resolution;R. Tauler and A. de Juan Three-Way Calibration with Hyphenated Data;K.S. Booksh Future Trends in Chemometrics;P.J. Gemperline Index
