Statistical Design - Chemometrics

Statistical Design - Chemometrics

Author: Roy E Bruns

Publisher: Elsevier

ISBN: 0080462138

Category: Science

Page: 422

View: 398

Get eBOOK →
Statistical Design-Chemometrics is applicable to researchers and professionals who wish to perform experiments in chemometrics and carry out analysis of the data in the most efficient way possible. The language is clear, direct and oriented towards real applications. The book provides 106 exercises with answers to accompany the study of theoretical principles. Forty two cases studies with real data are presented showing designs and the complete statistical analyses for problems in the areas chromatography, electroanalytical and electrochemistry, calibration, polymers, gas adsorption, semiconductors, food technology, biotechnology, photochemistry, catalysis, detergents and ceramics. These studies serve as a guide that the reader can use to perform correct data analyses. -Provides 42 case studies containing step-by-step descriptions of calculational procedures that can be applied to most real optimization problems -Contains 106 theoretical exercises to test individual learning and to provide classroom exercises and material for written tests and exams -Written in a language that facilitates learning for physical and biological scientists and engineers -Takes a practical approach for those involved in industrial optimization problems

Chemometrics

Chemometrics

Author: Ed Morgan

Publisher: John Wiley & Son Limited

ISBN: UCSD:31822031142979

Category: Science

Page: 304

View: 634

Get eBOOK →
Explores experimental design and its use in statistical analysis. Divided into five parts, it covers the statistical methods used in experimental design; introduces randomization, replication and blocking; explores designs with more than one factor focusing chiefly on two-level designs; examines fractional factorial designs; and discusses response surface methodology. Written by some of the foremost lecturers in analytical chemistry and designed for those who wish to study in a more flexible way than possible in traditional institutional learning.

Chemometrics in Environmental Chemistry - Statistical Methods

Chemometrics in Environmental Chemistry - Statistical Methods

Author: Jürgen Einax

Publisher: Springer

ISBN: 9783540491484

Category: Science

Page: 334

View: 736

Get eBOOK →
Pattern recognition and other chemometrical techniques are important tools in interpreting environmental data. This volume presents authoritatively state-of-the-art procedures for measuring and handling environmental data. The chapters are written by leading experts.

Experimental Design: A Chemometric Approach

Experimental Design: A Chemometric Approach

Author: S.N. Deming

Publisher: Elsevier

ISBN: 008086838X

Category: Science

Page: 436

View: 393

Get eBOOK →
Now available is the second edition of a book which has been described as "...an exceptionally lucid, easy-to-read presentation... would be an excellent addition to the collection of every analytical chemist. I recommend it with great enthusiasm." (Analytical Chemistry) N.R. Draper reviewed the first edition in Publication of the International Statistical Institute "...discussion is careful, sensible, amicable, and modern and can be recommended for the intended readership." The scope of the first edition has been revised, enlarged and expanded. Approximately 30% of the text is new. The book first introduces the reader to the fundamentals of experimental design. Systems theory, response surface concepts, and basic statistics serve as a basis for the further development of matrix least squares and hypothesis testing. The effects of different experimental designs and different models on the variance-covariance matrix and on the analysis of variance (ANOVA) are extensively discussed. Applications and advanced topics (such as confidence bands, rotatability, and confounding) complete the text. Numerous worked examples are presented. The clear and practical approach adopted by the authors makes the book applicable to a wide audience. It will appeal particularly to those with a practical need (scientists, engineers, managers, research workers) who have completed their formal education but who still need to know efficient ways of carrying out experiments. It will also be an ideal text for advanced undergraduate and graduate students following courses in chemometrics, data acquisition and treatment, and design of experiments.

Chemometrics in Environmental Analysis

Chemometrics in Environmental Analysis

Author: Jürgen W. Einax

Publisher: John Wiley & Sons

ISBN: 3527287728

Category: Science

Page: 404

View: 789

Get eBOOK →
J. W. Einax, H. W. Zwanziger S. Gei Chemometrics in Environmental Analysis Make the most of your data! This new title will serve both as an introduction and as a practical guide to those techniques of chemometrics which are applicable to environmental analysis. By describing the optimum methods of data analysis it will help all chemists in this field to save time and money. Because the authors demonstrate the most important chemometric methods with the aid of numerous examples, the reader will learn to solve a given problem by use of the appropriate method. Applications range from sampling, through laboratory analysis, to evaluation. Interpretation of the findings is explained clearly. The text covers not only basic methods such as univariate statistics, regression analysis, and statistical test planning, but also multivariate data analysis, for example, cluster analysis, principal components analysis, and factor and discriminant analysis. Case studies show the enormous possibilities, and the limits, of chemometric methods. The book will help all environmental analytical scientists, even those with only a basic knowledge of mathematics, to optimize the evaluation and interpretation of the results of their measurements.

Chemometrics in Practical Applications

Chemometrics in Practical Applications

Author: Kurt Varmuza

Publisher: BoD – Books on Demand

ISBN: 9789535104384

Category: Science

Page: 342

View: 766

Get eBOOK →
In the book "Chemometrics in practical applications", various practical applications of chemometric methods in chemistry, biochemistry and chemical technology are presented, and selected chemometric methods are described in tutorial style. The book contains 14 independent chapters and is devoted to filling the gap between textbooks on multivariate data analysis and research journals on chemometrics and chemoinformatics.

Chemometrics in Chromatography

Chemometrics in Chromatography

Author: Łukasz Komsta

Publisher: CRC Press

ISBN: 9781498772549

Category: Science

Page: 506

View: 919

Get eBOOK →
Chemometrics uses advanced mathematical and statistical algorithms to provide maximum chemical information by analyzing chemical data, and obtain knowledge of chemical systems. Chemometrics significantly extends the possibilities of chromatography and with the technological advances of the personal computer and continuous development of open-source software, many laboratories are interested in incorporating chemometrics into their chromatographic methods. This book is an up-to-date reference that presents the most important information about each area of chemometrics used in chromatography, demonstrating its effective use when applied to a chromatographic separation.

Experimental Design

Experimental Design

Author: Stanley N. Deming

Publisher: Elsevier Science Serials

ISBN: 0444891110

Category: Science

Page: 437

View: 521

Get eBOOK →
Now available is the second edition of a book which has been described as "...an exceptionally lucid, easy-to-read presentation... would be an excellent addition to the collection of every analytical chemist. I recommend it with great enthusiasm." (Analytical Chemistry) N.R. Draper reviewed the first edition in Publication of the International Statistical Institute "...discussion is careful, sensible, amicable, and modern and can be recommended for the intended readership." The scope of the first edition has been revised, enlarged and expanded. Approximately 30% of the text is new. The book first introduces the reader to the fundamentals of experimental design. Systems theory, response surface concepts, and basic statistics serve as a basis for the further development of matrix least squares and hypothesis testing. The effects of different experimental designs and different models on the variance-covariance matrix and on the analysis of variance (ANOVA) are extensively discussed. Applications and advanced topics (such as confidence bands, rotatability, and confounding) complete the text. Numerous worked examples are presented. The clear and practical approach adopted by the authors makes the book applicable to a wide audience. It will appeal particularly to those with a practical need (scientists, engineers, managers, research workers) who have completed their formal education but who still need to know efficient ways of carrying out experiments. It will also be an ideal text for advanced undergraduate and graduate students following courses in chemometrics, data acquisition and treatment, and design of experiments.

Chemometrics

Chemometrics

Author: Richard G. Brereton

Publisher: John Wiley & Sons

ISBN: 9781118904664

Category: Science

Page: 457

View: 200

Get eBOOK →
A new, full-color, completely updated edition of the key practical guide to chemometrics This new edition of this practical guide on chemometrics, emphasizes the principles and applications behind the main ideas in the field using numerical and graphical examples, which can then be applied to a wide variety of problems in chemistry, biology, chemical engineering, and allied disciplines. Presented in full color, it features expansion of the principal component analysis, classification, multivariate evolutionary signal and statistical distributions sections, and new case studies in metabolomics, as well as extensive updates throughout. Aimed at the large number of users of chemometrics, it includes extensive worked problems and chapters explaining how to analyze datasets, in addition to updated descriptions of how to apply Excel and Matlab for chemometrics. Chemometrics: Data Driven Extraction for Science, Second Edition offers chapters covering: experimental design, signal processing, pattern recognition, calibration, and evolutionary data. The pattern recognition chapter from the first edition is divided into two separate ones: Principal Component Analysis/Cluster Analysis, and Classification. It also includes new descriptions of Alternating Least Squares (ALS) and Iterative Target Transformation Factor Analysis (ITTFA). Updated descriptions of wavelets and Bayesian methods are included. Includes updated chapters of the classic chemometric methods (e.g. experimental design, signal processing, etc.) Introduces metabolomics-type examples alongside those from analytical chemistry Features problems at the end of each chapter to illustrate the broad applicability of the methods in different fields Supplemented with data sets and solutions to the problems on a dedicated website, www.booksupport.wiley.com Chemometrics: Data Driven Extraction for Science, Second Edition is recommended for post-graduate students of chemometrics as well as applied scientists (e.g. chemists, biochemists, engineers, statisticians) working in all areas of data analysis.

State Estimation in Chemometrics

State Estimation in Chemometrics

Author: Pierre C. Thijssen

Publisher: Woodhead Publishing

ISBN: 9780081026229

Category: Science

Page: 294

View: 785

Get eBOOK →
This unique text blends together state estimation and chemometrics for the application of advanced data-processing techniques. State Estimation in Chemometrics, second edition describes the basic methods for chemical analysis—the multicomponent, calibration and titration systems—from a new perspective. It succinctly reviews the history of state estimation and chemometrics and provides examples of its many applications, including classical estimation, state estimation, nonlinear estimation, the multicomponent, calibration and titration systems and the Kalman filter. The concepts are introduced in a logical way and built up systematically to appeal to specialist post-graduates working in this area as well as professionals in other areas of chemistry and engineering. This new edition covers the latest research in chemometrics, appealing to readers in bio-engineering, food science, pharmacy, and the life sciences fostering cross-disciplinary research. Features a new chapter surveying the most up-to-date scientific literature on chemometrics, highlighting developments that have occurred since the first edition published Includes a new chapter devoted to new applications for state estimation in chemometrics Covers a new chapter entirely devoted to subspace identification methods Provides several new real-life examples of methods such as multiple modeling, principal component analysis, iterative target transformation factor analysis, and the generalized standard addition method

Chemometric Methods in Molecular Design

Chemometric Methods in Molecular Design

Author: Han van de Waterbeemd

Publisher: John Wiley & Sons

ISBN: 9783527615445

Category: Science

Page: 379

View: 690

Get eBOOK →
The statistical analysis of experimental and theoretical data lies at the heart of modern drug design. This practice-oriented handbook is a comprehensive account of modern chemometric methods in molecular design. It presents strategies for making more rational choices in the planning of syntheses, and describes techniques for analyzing biological and chemical data. Written by the world's experts, it provides in-depth information on * molecular concepts * experimental design in the planning of syntheses * multivariate analysis of chemical and biological data * statistical validation of QSAR results An additional benefit: the book contains a critical survey of commercially available software packages both for statistical analysis as well as for special applications. Industrial and academic researches in medicinal chemistry and organic chemistry will value this book as a useful source of information for their daily work. Also available: Advanced Computer-Assisted Techniques in Drug Discovery, edited by H. van de Waterbeemd

Comprehensive Chemometrics

Comprehensive Chemometrics

Author: Steven Brown

Publisher: Elsevier

ISBN: 9780444527011

Category: Science

Page: 691

View: 466

Get eBOOK →
Designed to serve as the first point of reference on the subject, Comprehensive Chemometrics presents an integrated summary of the present state of chemical and biochemical data analysis and manipulation. The work covers all major areas ranging from statistics to data acquisition, analysis, and applications. This major reference work provides broad-ranging, validated summaries of the major topics in chemometrics—with chapter introductions and advanced reviews for each area. The level of material is appropriate for graduate students as well as active researchers seeking a ready reference on obtaining and analyzing scientific data. Features the contributions of leading experts from 21 countries, under the guidance of the Editors-in-Chief and a team of specialist Section Editors: L. Buydens; D. Coomans; P. Van Espen; A. De Juan; J.H. Kalivas; B.K. Lavine; R. Leardi; R. Phan-Tan-Luu; L.A. Sarabia; and J. Trygg Examines the merits and limitations of each technique through practical examples and extensive visuals: 368 tables and more than 1,300 illustrations (750 in full color) Integrates coverage of chemical and biological methods, allowing readers to consider and test a range of techniques Consists of 2,200 pages and more than 90 review articles, making it the most comprehensive work of its kind Offers print and online purchase options, the latter of which delivers flexibility, accessibility, and usability through the search tools and other productivity-enhancing features of ScienceDirect