introduction to multivariate statistical analysis in chemometrics

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Introduction To Multivariate Statistical Analysis In Chemometrics

Author : Kurt Varmuza
ISBN : 1420059491
Genre : Science
File Size : 74. 31 MB
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Using formal descriptions, graphical illustrations, practical examples, and R software tools, Introduction to Multivariate Statistical Analysis in Chemometrics presents simple yet thorough explanations of the most important multivariate statistical methods for analyzing chemical data. It includes discussions of various statistical methods, such as principal component analysis, regression analysis, classification methods, and clustering. Written by a chemometrician and a statistician, the book reflects the practical approach of chemometrics and the more formally oriented one of statistics. To enable a better understanding of the statistical methods, the authors apply them to real data examples from chemistry. They also examine results of the different methods, comparing traditional approaches with their robust counterparts. In addition, the authors use the freely available R package to implement methods, encouraging readers to go through the examples and adapt the procedures to their own problems. Focusing on the practicality of the methods and the validity of the results, this book offers concise mathematical descriptions of many multivariate methods and employs graphical schemes to visualize key concepts. It effectively imparts a basic understanding of how to apply statistical methods to multivariate scientific data.

Introduction To Multivariate Statistical Analysis In Chemometrics

Author : Kurt Varmuza
ISBN : 1420059475
Genre : Mathematics
File Size : 80. 33 MB
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Using formal descriptions, graphical illustrations, practical examples, and R software tools, this text presents simple yet thorough explanations of the most important multivariate statistical methods for analyzing chemical data.

Chemometrics With R

Author : Ron Wehrens
ISBN : 3642178413
Genre : Science
File Size : 70. 59 MB
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"Chemometrics with R" offers readers an accessible introduction to the world of multivariate statistics in the life sciences, providing a complete description of the general data analysis paradigm, from exploratory analysis to modeling to validation. Several more specific topics from the area of chemometrics are included in a special section. The corresponding R code is provided for all the examples in the book; scripts, functions and data are available in a separate, publicly available R package. For researchers working in the life sciences, the book can also serve as an easy-to-use primer on R.

Chemometrics In Excel

Author : Alexey L. Pomerantsev
ISBN : 9781118873267
Genre : Science
File Size : 79. 34 MB
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Providing an easy explanation of the fundamentals, methods, and applications of chemometrics • Acts as a practical guide to multivariate data analysis techniques • Explains the methods used in Chemometrics and teaches the reader to perform all relevant calculations • Presents the basic chemometric methods as worksheet functions in Excel • Includes Chemometrics Add In for download which uses Microsoft Excel® for chemometrics training • Online downloads includes workbooks with examples

Applied Chemometrics For Scientists

Author : Richard G. Brereton
ISBN : 9780470057773
Genre : Science
File Size : 48. 95 MB
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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).

Comprehensive Chemometrics

Author : Steven D. Brown
ISBN : 044452701X
Genre : Science
File Size : 83. 48 MB
Format : PDF
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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

Multivariate Analysis Of Quality

Author : Harald Martens
ISBN : 0471974285
Genre : Mathematics
File Size : 55. 76 MB
Format : PDF, Kindle
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Data analysis is a vital part of science today, and in assessing quality, multivariate analysis is often necessary in order to avoid loss of essential information. Martens provides a powerful and versatile methodology that enables researchers to design their investigations and analyse data effectively and safely, without the need for formal statistical training. * Offers an introductory explanation of multivariate analysis by graphical 'soft modelling' * Minimises mathematics, providing all technical details in the appendix * Presents itself in an accessible style with cartoons, self-assessment questions and a wide range of practical examples * Demonstrates the methodology for various types of quality assessment, ranging from human quality perception via industrial quality monitoring to environmental quality and its molecular basis All data sets available FREE online on "Chemometrics World" (http://www.wiley.co.uk/wileychi/chemometrics)

Chemometric Methods In Capillary Electrophoresis

Author : Grady Hanrahan
ISBN : 0470530189
Genre : Science
File Size : 29. 3 MB
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Use chemometric techniques to develop optimum separation conditions for capillary electrophoreses For all its advantages, capillary electrophoresis (CE) also carries significant disadvantages for the researcher. Offering a unique blend of information from authors active in a variety of developments of chemometrics in CE, Chemometric Methods in Capillary Electrophoresis presents modern chemometric methods as an alternative to help alleviate the problems commonly encountered during routine analysis and method development. Focusing on current chemometric methods utilized in CE endeavours by research-active experts in the field, the book begins with a thorough introduction to CE and chemometric-related concepts and the need for modern chemometric methods in CE. Part 1 discusses differing types of screening designs and response surface methodology¿in an¿application based format Part 2 includes vital discussion on various exploratory data analysis, prediction, and classification techniques utilized in CE-related studies Part 3 provides practical information on modelling quantitative structure relationships Part 4 explores transformation techniques, in particular fundamental studies and applications of cross-correlation and Hadamard Transform Electrophoresis Showing how chemometric methods are applied in a wide array of applications including biological, medical, pharmaceutical, food, forensic, and environmental science, Chemometric Methods in Capillary Electrophoresis is not only highly significant to capillary electrophoresis-based endeavours, but instructive for investigators active in other areas of separation science who could benefit from its informative content.

Chemometrics In Environmental Analysis

Author : Jürgen W. Einax
ISBN : 3527287728
Genre : Science
File Size : 76. 96 MB
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J. W. Einax, H. W. Zwanziger S. Geiß 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

Author : Matthias Otto
ISBN : 3527314180
Genre : Science
File Size : 70. 93 MB
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The field of chemometrics is the bridge between chemistry and mathematics. This book explains how it is used in interpreting, evaluating and analysing data resulting from analytical measurements, to obtain a maximum of information from the data.

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