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Author : Henk L. C. Meuzelaar
Publisher :
ISBN 13 :
Total Pages : pages
Book Rating : 4.:/5 (87 download)
Download or read book Computer-enhanced Analytical Spectroscopy written by Henk L. C. Meuzelaar and published by . This book was released on 1987 with total page pages. Available in PDF, EPUB and Kindle. Book excerpt:
Author : Henk Meuzelaar
Publisher : Springer
ISBN 13 : 9780306426445
Total Pages : 288 pages
Book Rating : 4.4/5 (264 download)
Download or read book Computer-Enhanced Analytical Spectroscopy written by Henk Meuzelaar and published by Springer. This book was released on 1988-01-31 with total page 288 pages. Available in PDF, EPUB and Kindle. Book excerpt: June 1986 brought together some of the world's leaders in computer enhanced analytical spectroscopy at Snowbird, Utah, for what the attendees decided to call "The First Hidden Peak Symposium." With the remarkable advances in both computer hardware and software, it is interesting to observe that, while many computational aspects of spectroscopic analysis have become routine, some of the more fundamental problems remain unsolved. The group that assembled included many of those who started trying to interpret chemical spectroscopy when computers were ponderous, slow, and not very accessible, as well as newcomers who never knew the day that spectrometers were delivered without attached computers. The synergism was excellent. Many new ideas, as well as this volume, resulted from interactions among the participants. The conclusion was that progress would be made on more fundamen tal problems now that hardware, software, and mathematics were coming together on a more sophisticated level. The feeling was that the level of sophistication is now adequate and that it is only a matter of time before automated spectral interpretation surpasses all but the most advanced human experts.
Author : Henk Meuzelaar
Publisher : Springer Science & Business Media
ISBN 13 : 1468453688
Total Pages : 280 pages
Book Rating : 4.4/5 (684 download)
Download or read book Computer-Enhanced Analytical Spectroscopy written by Henk Meuzelaar and published by Springer Science & Business Media. This book was released on 2013-03-08 with total page 280 pages. Available in PDF, EPUB and Kindle. Book excerpt: June 1986 brought together some of the world's leaders in computer enhanced analytical spectroscopy at Snowbird, Utah, for what the attendees decided to call "The First Hidden Peak Symposium." With the remarkable advances in both computer hardware and software, it is interesting to observe that, while many computational aspects of spectroscopic analysis have become routine, some of the more fundamental problems remain unsolved. The group that assembled included many of those who started trying to interpret chemical spectroscopy when computers were ponderous, slow, and not very accessible, as well as newcomers who never knew the day that spectrometers were delivered without attached computers. The synergism was excellent. Many new ideas, as well as this volume, resulted from interactions among the participants. The conclusion was that progress would be made on more fundamen tal problems now that hardware, software, and mathematics were coming together on a more sophisticated level. The feeling was that the level of sophistication is now adequate and that it is only a matter of time before automated spectral interpretation surpasses all but the most advanced human experts.
Author : Charles L. Wilkins
Publisher : Springer
ISBN 13 : 9780306444562
Total Pages : 0 pages
Book Rating : 4.4/5 (445 download)
Download or read book Computer-Enhanced Analytical Spectroscopy Volume 4 written by Charles L. Wilkins and published by Springer. This book was released on 1994-01-31 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: The current volume covers research advances in nuclear magnetic resonance, mass spectrometry, and optical spectroscopy with emphasis on computer-assisted interpretation methodologies.
Author : Henk L. C. Meuzelaar
Publisher : Modern Analytical Chemistry
ISBN 13 :
Total Pages : 336 pages
Book Rating : 4.3/5 (91 download)
Download or read book Computer-Enhanced Analytical Spectroscopy Volume 4 written by Henk L. C. Meuzelaar and published by Modern Analytical Chemistry. This book was released on 1993 with total page 336 pages. Available in PDF, EPUB and Kindle. Book excerpt: Carbon-13 nuclear magnetic resonance spectrum simulation; New approaches to computer-aided NMR interpretation and structure prediction; Multivariate data analysis of 2D NMR matrices; Deconvolution and quantitative enhancement of multidimensional spectra; Automatic analysis and simulation of mass spectra; Multivariate analysis of time-resolved pyrolysis mass spectral data; Extracting qualitative and quantitative information from infrared emission spectral data; Confirmation of detected species using Kovats indices and very low resolution spectrometry correlation analysis; The synergy of computational chemistry and spectroscopy in understanding molecular structure and dynamics at interfaces; Enhancement of chemical information through computer-assisted examination of spectral variations; Resolving unmodeled components from UV-visible spectra with adaptive filtering; Artificial intelligence and neural networks applied to ion mobility spectrometry.
Author : Steven D. Brown
Publisher :
ISBN 13 :
Total Pages : 284 pages
Book Rating : 4.3/5 (91 download)
Download or read book Computer-Assisted Analytical Spectroscopy written by Steven D. Brown and published by . This book was released on 1996-08-06 with total page 284 pages. Available in PDF, EPUB and Kindle. Book excerpt: Based on presentations at the Fifth Symposium of Computer-Enhanced Analytical Spectroscopy, 1994, Computer-Assisted Analytical Spectroscopy is essentially divided into two parts. The first focuses on innovations associated with modern analytical measurements brought about through the use of computer methods in spectroscopy. Enhancements to vibrational, fluorescence, and mass spectroscopy are discussed. The main emphasis of the second part is placed on novel methods for dealing with problems arising in computer-assisted analysis of spectropic data. Throughout, practical applications of the techniques presented are described.
Author :
Publisher : Academic Press
ISBN 13 : 0128032251
Total Pages : 3716 pages
Book Rating : 4.1/5 (28 download)
Download or read book Encyclopedia of Spectroscopy and Spectrometry written by and published by Academic Press. This book was released on 2016-09-22 with total page 3716 pages. Available in PDF, EPUB and Kindle. Book excerpt: This third edition of the Encyclopedia of Spectroscopy and Spectrometry, Three Volume Set provides authoritative and comprehensive coverage of all aspects of spectroscopy and closely related subjects that use the same fundamental principles, including mass spectrometry, imaging techniques and applications. It includes the history, theoretical background, details of instrumentation and technology, and current applications of the key areas of spectroscopy. The new edition will include over 80 new articles across the field. These will complement those from the previous edition, which have been brought up-to-date to reflect the latest trends in the field. Coverage in the third edition includes: Atomic spectroscopy Electronic spectroscopy Fundamentals in spectroscopy High-Energy spectroscopy Magnetic resonance Mass spectrometry Spatially-resolved spectroscopic analysis Vibrational, rotational and Raman spectroscopies The new edition is aimed at professional scientists seeking to familiarize themselves with particular topics quickly and easily. This major reference work continues to be clear and accessible and focus on the fundamental principles, techniques and applications of spectroscopy and spectrometry. Incorporates more than 150 color figures, 5,000 references, and 300 articles for a thorough examination of the field Highlights new research and promotes innovation in applied areas ranging from food science and forensics to biomedicine and health Presents a one-stop resource for quick access to answers and an in-depth examination of topics in the spectroscopy and spectrometry arenas
Author : Foo-Tim Chau
Publisher : John Wiley & Sons
ISBN 13 : 0471202428
Total Pages : 342 pages
Book Rating : 4.4/5 (712 download)
Download or read book Chemometrics written by Foo-Tim Chau and published by John Wiley & Sons. This book was released on 2004-03-25 with total page 342 pages. Available in PDF, EPUB and Kindle. Book excerpt: Wavelet Transformations and Their Applications in Chemistry pioneers a new approach to classifying existing chemometric techniques for data analysis in one and two dimensions, using a practical applications approach to illustrating chemical examples and problems. Written in a simple, balanced, applications-based style, the book is geared to both theorists and non-mathematicians. This text emphasizes practical applications in chemistry. It employs straightforward language and examples to show the power of wavelet transforms without overwhelming mathematics, reviews other methods, and compares wavelets with other techniques that provide similar capabilities. It uses examples illustrated in MATLAB codes to assist chemists in developing applications, and includes access to a supplementary Web site providing code and data sets for work examples. Wavelet Transformations and Their Applications in Chemistry will prove essential to professionals and students working in analytical chemistry and process chemistry, as well as physical chemistry, spectroscopy, and statistics.
Author : Mike J. Adams
Publisher : Royal Society of Chemistry
ISBN 13 : 9780854045952
Total Pages : 248 pages
Book Rating : 4.0/5 (459 download)
Download or read book Chemometrics in Analytical Spectroscopy written by Mike J. Adams and published by Royal Society of Chemistry. This book was released on 2004 with total page 248 pages. Available in PDF, EPUB and Kindle. Book excerpt: Chemometrics in Analytical Spectroscopy provides students and practising analysts with a tutorial guide to the use and application of the more commonly encountered techniques used in processing and interpreting analytical spectroscopic data. In detail the book covers the basic elements of univariate and multivariate data analysis, the acquisition of digital data and signal enhancement by filtering and smoothing, feature selection and extraction, pattern recognition, exploratory data analysis by clustering, and common algorithms in use for multivariate calibration techniques. An appendix is included which serves as an introduction or refresher in matrix algebra. The extensive use of worked examples throughout gives Chemometrics in Analytical Spectroscopy special relevance in teaching and introducing chemometrics to undergraduates and post-graduates undertaking analytical science courses. It assumes only a very moderate level of mathematics, making the material far more accessible than other publications on chemometrics. The book is also ideal for analysts with little specialist background in statistics or mathematical methods, who wish to appreciate the wealth of material published in chemometrics.
Author : Harald Martens
Publisher : John Wiley & Sons
ISBN 13 : 9780471930471
Total Pages : 444 pages
Book Rating : 4.9/5 (34 download)
Download or read book Multivariate Calibration written by Harald Martens and published by John Wiley & Sons. This book was released on 1992-08-07 with total page 444 pages. Available in PDF, EPUB and Kindle. Book excerpt: Multivariate Calibration Harald Martens, Chemist, Norwegian Food Research Institute, Aas, Norway and Norwegian Computing Center, Oslo, Norway Tormod Næs, Statistician, Norwegian Food Research Institute, Aas, Norway The aim of this inter-disciplinary book is to present an up-to-date view of multivariate calibration of analytical instruments, for use in research, development and routine laboratory and process operation. The book is intended to show practitioners in chemistry and technology how to extract the quantitative and understandable information embedded in non-selective, overwhelming and apparently useless measurements by multivariate data analysis. Multivariate calibration is the process of learning how to combine data from several channels, in order to overcome selectivity problems, gain new insight and allow automatic outlier detection. Multivariate calibration is the basis for the present success of high-speed Near-Infrared (NIR) diffuse spectroscopy of intact samples. But the technique is very general: it has shown similar advantages in, for instance, UV, Vis, and IR spectrophotometry, (transmittance, reflectance and fluorescence), for x-ray diffraction, NMR, MS, thermal analysis, chromatography (GC, HPLC) and for electrophoresis and image analysis (tomography, microscopy), as well as other techniques. The book is written at two levels: the main level is structured as a tutorial on the practical use of multivariate calibration techniques. It is intended for university courses and self-study for chemists and technologists, giving one complete and versatile approach, based mainly on data compression methodology in self-modelling PLS regression, with considerations of experimental design, data pre-processing and model validation. A second, more methodological, level is intended for statisticians and specialists in chemometrics. It compares several alternative calibration methods, validation approaches and ways to optimize the models. The book also outlines some cognitive changes needed in analytical chemistry, and suggests ways to overcome some communication problems between statistics and chemistry and technology.
Author : Kenny B. Lipkowitz
Publisher : John Wiley & Sons
ISBN 13 : 0471458813
Total Pages : 431 pages
Book Rating : 4.4/5 (714 download)
Download or read book Reviews in Computational Chemistry, Volume 17 written by Kenny B. Lipkowitz and published by John Wiley & Sons. This book was released on 2003-05-08 with total page 431 pages. Available in PDF, EPUB and Kindle. Book excerpt: Computational chemistry is increasingly used in most areas of molecular science including organic, inorganic, medicinal, biological, physical, and analytical chemistry. Researchers in these fields who do molecular modelling need to understand and stay current with recent developments. This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Two chapters focus on molecular docking, one of which relates to drug discovery and cheminformatics and the other to proteomics. In addition, this volume contains tutorials on spin-orbit coupling and cellular automata modeling, as well as an extensive bibliography of computational chemistry books. FROM REVIEWS OF THE SERIES "Reviews in Computational Chemistry remains the most valuable reference to methods and techniques in computational chemistry."—JOURNAL OF MOLECULAR GRAPHICS AND MODELLING "One cannot generally do better than to try to find an appropriate article in the highly successful Reviews in Computational Chemistry. The basic philosophy of the editors seems to be to help the authors produce chapters that are complete, accurate, clear, and accessible to experimentalists (in particular) and other nonspecialists (in general)."—JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
Author : Richard J. P. Cannell
Publisher : Springer Science & Business Media
ISBN 13 : 0896033627
Total Pages : 958 pages
Book Rating : 4.8/5 (96 download)
Download or read book Natural Products Isolation written by Richard J. P. Cannell and published by Springer Science & Business Media. This book was released on 1998 with total page 958 pages. Available in PDF, EPUB and Kindle. Book excerpt: Natural Products Isolation provides a comprehensive introduction to techniques for the extraction and purification of natural products from all biological sources. Geared to scientists with little experience of natural products extraction, but offering even skilled researchers valuable advice and insight, Natural Products Isolation lays the foundation for the potential extractor to isolate natural substances efficiently. Its methods and guidance will almost certainly play a major role in today's natural product discovery and development.
Author : Zeev B. Alfassi
Publisher : John Wiley & Sons
ISBN 13 : 1405148144
Total Pages : 272 pages
Book Rating : 4.4/5 (51 download)
Download or read book Statistical Treatment of Analytical Data written by Zeev B. Alfassi and published by John Wiley & Sons. This book was released on 2009-02-12 with total page 272 pages. Available in PDF, EPUB and Kindle. Book excerpt: Statistical techniques have assumed an integral role in both the interpretation and quality assessment of analytical results. In this book the range of statistical methods available for such tasks are described in detail, with the advantages and disadvantages of each technique clarified by use of examples. With a focus on the essential practical application of these techniques the book also includes sufficient theory to facilitate understanding of the statistical principles involved. Statistical Treatment of Analytical Data is written for professional analytical chemists in industry, government and research institutions who require a practical understanding of the application of statistics in day to day activities in the analytical laboratory. It is also for students who require further and detailed information that may not be available directly in a typical undergraduate course.
Author : Joseph Dubrovkin
Publisher : Cambridge Scholars Publishing
ISBN 13 : 1527580377
Total Pages : 511 pages
Book Rating : 4.5/5 (275 download)
Download or read book Data Analytics in Spectroscopy written by Joseph Dubrovkin and published by Cambridge Scholars Publishing. This book was released on 2024-02-06 with total page 511 pages. Available in PDF, EPUB and Kindle. Book excerpt: This textbook summarizes various studies and significant materials on data analytics in spectroscopy. Its rigorous mathematical basis, in-depth description, and numerous examples of applications in chemistry and physics make this book valuable for theorists, practitioners, and students specializing in data processing in spectroscopy, chemometrics, and analytical chemistry. The bibliography briefly describes hundreds of data analytics applications for solving spectroscopic tasks in industrial and research laboratories. This book differs from existing brief reviews and articles on this topic in that it forms, for the first time, the big picture of all kinds of data analytics methods in spectroscopy. The book also provides quickly reproducible computer calculations to illustrate its significant theoretical statements. As such, it can also serve as a practical guide to lecturers in data analytics in the broad field of spectroscopy, including chemometrics and analytical chemistry.
Author : Thomas Engel
Publisher : John Wiley & Sons
ISBN 13 : 3527806547
Total Pages : 416 pages
Book Rating : 4.5/5 (278 download)
Download or read book Applied Chemoinformatics written by Thomas Engel and published by John Wiley & Sons. This book was released on 2018-04-19 with total page 416 pages. Available in PDF, EPUB and Kindle. Book excerpt: Edited by world-famous pioneers in chemoinformatics, this is a clearly structured and applications-oriented approach to the topic, providing up-to-date and focused information on the wide range of applications in this exciting field. The authors explain methods and software tools, such that the reader will not only learn the basics but also how to use the different software packages available. Experts describe applications in such different fields as structure-spectra correlations, virtual screening, prediction of active sites, library design, the prediction of the properties of chemicals, the development of new cosmetics products, quality control in food, the design of new materials with improved properties, toxicity modeling, assessment of the risk of chemicals, and the control of chemical processes. The book is aimed at advanced students as well as lectures but also at scientists that want to learn how chemoinformatics could assist them in solving their daily scientific tasks. Together with the corresponding textbook Chemoinformatics - Basic Concepts and Methods (ISBN 9783527331093) on the fundamentals of chemoinformatics readers will have a comprehensive overview of the field.
Author : Angel P. del Pobil
Publisher : Springer
ISBN 13 : 3540693483
Total Pages : 911 pages
Book Rating : 4.5/5 (46 download)
Download or read book Methodology and Tools in Knowledge-Based Systems written by Angel P. del Pobil and published by Springer. This book was released on 2006-04-11 with total page 911 pages. Available in PDF, EPUB and Kindle. Book excerpt: This two-volume set constitutes the refereed proceedings of the 11th International Conference on Industrial and Engineering Applications of Artificial Intelligence and Expert Systems, IEA/AIE-98, held in Benicassim, Castellon, Spain, in June 1998.The two volumes present a total of 187 revised full papers selected from 291 submissions. In accordance with the conference, the books are devoted to new methodologies, knowledge modeling and hybrid techniques. The papers explore applications from virtually all subareas of AI including knowledge-based systems, fuzzyness and uncertainty, formal reasoning, neural information processing, multiagent systems, perception, robotics, natural language processing, machine learning, supervision and control systems, etc..
Author : Katherine A. Bakeev
Publisher : John Wiley & Sons
ISBN 13 : 0470689609
Total Pages : 576 pages
Book Rating : 4.4/5 (76 download)
Download or read book Process Analytical Technology written by Katherine A. Bakeev and published by John Wiley & Sons. This book was released on 2010-04-01 with total page 576 pages. Available in PDF, EPUB and Kindle. Book excerpt: Process Analytical Technology explores the concepts of PAT and its application in the chemical and pharmaceutical industry from the point of view of the analytical chemist. In this new edition all of the original chapters have been updated and revised, and new chapters covering the important topics of sampling, NMR, fluorescence, and acoustic chemometrics have been added. Coverage includes: Implementation of Process Analytical Technologies UV-Visible Spectroscopy for On-line Analysis Infrared Spectroscopy for Process Analytical Applications Process Raman Spectroscopy Process NMR Spectrscopy: Technology and On-line Applications Fluorescent Sensing and Process Analytical Applications Chemometrics in Process Analytical Technology (PAT) On-Line PAT Applications of Spectroscopy in the Pharmaceutical Industry Future Trends for PAT for Increased Process Understanding and Growing Applications in Biomanufacturing NIR Chemical Imaging This volume is an important starting point for anyone wanting to implement PAT and is intended not only to assist a newcomer to the field but also to provide up-to-date information for those who practice process analytical chemistry and PAT. It is relevant for chemists, chemical and process engineers, and analytical chemists working on process development, scale-up and production in the pharmaceutical, fine and specialty chemicals industries, as well as for academic chemistry, chemical engineering, chemometrics and pharmaceutical science research groups focussing on PAT. Review from the First Edition “The book provides an excellent first port of call for anyone seeking material and discussions to understand the area better. It deserves to be found in every library that serves those who are active in the field of Process Analytical Technology.”—Current Engineering Practice
