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Computer Assisted Structure Elucidation Ranking Of Candidate Structures Based On Comparison Between Predicted And Observed Mass Spectra
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Book Synopsis Computer Assisted Structure Elucidation, Ranking of Candidate Structures, Based on Comparison Between Predicted and Observed Mass Spectra by : Stanford University. Computer Science Dept. Heuristic Programming Project
Download or read book Computer Assisted Structure Elucidation, Ranking of Candidate Structures, Based on Comparison Between Predicted and Observed Mass Spectra written by Stanford University. Computer Science Dept. Heuristic Programming Project and published by . This book was released on with total page 4 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Book Synopsis Computer-assisted Structure Elucidation by : Neil A. B. Gray
Download or read book Computer-assisted Structure Elucidation written by Neil A. B. Gray and published by Wiley-Interscience. This book was released on 1986 with total page 568 pages. Available in PDF, EPUB and Kindle. Book excerpt: Drawing on a wide range of recent research, this book introduces the most important new algorithms for solving problems in structural chemistry. It is a review of problems related to the representation and manipulation of chemical data, illustrated with various approaches to their solutions.
Book Synopsis Readings in Artificial Intelligence by : Bonnie Lynn Webber
Download or read book Readings in Artificial Intelligence written by Bonnie Lynn Webber and published by Morgan Kaufmann. This book was released on 2014-05-12 with total page 558 pages. Available in PDF, EPUB and Kindle. Book excerpt: Readings in Artificial Intelligence focuses on the principles, methodologies, advancements, and approaches involved in artificial intelligence. The selection first elaborates on representations of problems of reasoning about actions, a problem similarity approach to devising heuristics, and optimal search strategies for speech understanding control. Discussions focus on comparison with existing speech understanding systems, empirical comparisons of the different strategies, analysis of distance function approximation, problem similarity, problems of reasoning about action, search for solution in the reduction system, and relationship between the initial search space and the higher level search space. The book then examines consistency in networks of relations, non-resolution theorem proving, using rewriting rules for connection graphs to prove theorems, and closed world data bases. The manuscript tackles a truth maintenance system, elements of a plan-based theory of speech acts, and reasoning about knowledge and action. Topics include problems in reasoning about knowledge, integration knowledge and action, models of plans, compositional adequacy, truth maintenance mechanisms, dialectical arguments, and assumptions and the problem of control. The selection is a valuable reference for researchers wanting to explore the field of artificial intelligence.
Book Synopsis The Handbook of Artificial Intelligence by : Avron Barr
Download or read book The Handbook of Artificial Intelligence written by Avron Barr and published by Butterworth-Heinemann. This book was released on 2014-05-12 with total page 443 pages. Available in PDF, EPUB and Kindle. Book excerpt: The Handbook of Artificial Intelligence, Volume II focuses on the improvements in artificial intelligence (AI) and its increasing applications, including programming languages, intelligent CAI systems, and the employment of AI in medicine, science, and education. The book first elaborates on programming languages for AI research and applications-oriented AI research. Discussions cover scientific applications, teiresias, applications in chemistry, dependencies and assumptions, AI programming-language features, and LISP. The manuscript then examines applications-oriented AI research in medicine and education, including ICAI systems design, intelligent CAI systems, medical systems, and other applications of AI to education. The manuscript explores automatic programming, as well as the methods of program specification, basic approaches, and automatic programming systems. The book is a valuable source of data for computer science experts and researchers interested in conducting further research in artificial intelligence.
Book Synopsis Computer-Based Structure Elucidation from Spectral Data by : Mikhail E. Elyashberg
Download or read book Computer-Based Structure Elucidation from Spectral Data written by Mikhail E. Elyashberg and published by . This book was released on 2015 with total page pages. Available in PDF, EPUB and Kindle. Book excerpt: Here, the authors introduce readers to solving molecular structure elucidation problems using the expert system ACD/Structure Elucidator. They explain in detail the concepts of the Computer-Assisted Structure Elucidation (CASE) approach and point out the crucial role of understanding the axiomatic nature of the data used to deduce the structure. Aspects covered include the main blocks of the expert system and essential features of the mathematical algorithms used. Graduate and PhD students as well as practicing chemists are provided with a detailed explanation of the various practical approaches depending on available spectral data peculiarities and the complexity of the unknown structure. This is supported by a large number of real-world completed examples, most of which are related to the structure elucidation of natural product molecules containing unusual skeletons. Dedicated software and further supplementary material are available at www.acdlabs.com/TeachingSE.
Book Synopsis Computation and Intelligence by : George F. Luger
Download or read book Computation and Intelligence written by George F. Luger and published by MIT Press. This book was released on 1995 with total page 762 pages. Available in PDF, EPUB and Kindle. Book excerpt: This work presents readings in artificial intelligence that should be of relevance to current students and practitioners. It is divided into five parts - each reflecting the stages of development of AI - which include "Foundations", "Knowledge Representation" and "Weak Method Problem Solving".
Book Synopsis The Scientific DataLink Index to Artificial Intelligence Research, 1954-1984: Abstracts II by : Scientific DataLink
Download or read book The Scientific DataLink Index to Artificial Intelligence Research, 1954-1984: Abstracts II written by Scientific DataLink and published by . This book was released on 1985 with total page 700 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Book Synopsis Applications of Artificial Intelligence for Organic Chemistry by : Robert K. Lindsay
Download or read book Applications of Artificial Intelligence for Organic Chemistry written by Robert K. Lindsay and published by McGraw-Hill Companies. This book was released on 1980 with total page 216 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Book Synopsis Computer-Aided Structure Elucidation by : Ernö Pretsch
Download or read book Computer-Aided Structure Elucidation written by Ernö Pretsch and published by Wiley-VCH. This book was released on 2002-12-30 with total page 308 pages. Available in PDF, EPUB and Kindle. Book excerpt: Interpreting spectra is often one of the unavoidable tasks for every chemist, unfortunately taking up much time. This book provides practical instructions and a software package for a faster, simpler yet more reliable structure elucidation. ? covers the most important analytical methods (MS, IR and NMR) ? combination of modern theory and practical software is ideal for any user ? experienced and successful team of authors ? invaluable source of information for all students, organic chemists and spectroscopists ? numerous spectral examples with comments
Book Synopsis The Artificial Intelligence Compendium: Author and title indices by :
Download or read book The Artificial Intelligence Compendium: Author and title indices written by and published by . This book was released on 1988 with total page 712 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Book Synopsis An Automated Structure Elucidation System for MS/MS Data by : Kevin Patrick Cross
Download or read book An Automated Structure Elucidation System for MS/MS Data written by Kevin Patrick Cross and published by . This book was released on 1985 with total page 362 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Book Synopsis The Artificial Intelligence Compendium: Subject index I, A-Men by :
Download or read book The Artificial Intelligence Compendium: Subject index I, A-Men written by and published by . This book was released on 1988 with total page 424 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Biotechnology Resources written by and published by . This book was released on 1981 with total page 76 pages. Available in PDF, EPUB and Kindle. Book excerpt: Directory of resources that serve the national biomedical community with new technologies and procedures. Arrangement according to category of resource service, i.e., Computer resources, Biomedical engineering resources, Biological structure and function, and Cellular and biochemical materials. Each entry gives title of resource, investigator, descriptions of equipment and personnel, objectives or applications, and current research. Geographical index.
Book Synopsis Plant Metabolomics by : Kazuki Saito
Download or read book Plant Metabolomics written by Kazuki Saito and published by Springer Science & Business Media. This book was released on 2006-06-29 with total page 351 pages. Available in PDF, EPUB and Kindle. Book excerpt: Metabolomics – which deals with all metabolites of an organism – is a rapidly-emerging sector of post-genome research fields. It plays significant roles in a variety of fields from medicine to agriculture and holds a fundamental position in functional genomics studies and their application in plant biotechnology. This volume comprehensively covers plant metabolomics for the first time. The chapters offer cutting-edge information on analytical technology, bioinformatics and applications. They were all written by leading researchers who have been directly involved in plant metabolomics research throughout the world. Up-to-date information and future developments are described, thereby producing a volume which is a landmark of plant metabolomics research and a beneficial guideline to graduate students and researchers in academia, industry, and technology transfer organizations in all plant science fields.
Book Synopsis Mathematical Chemistry and Chemoinformatics by : Adalbert Kerber
Download or read book Mathematical Chemistry and Chemoinformatics written by Adalbert Kerber and published by Walter de Gruyter. This book was released on 2013-12-12 with total page 521 pages. Available in PDF, EPUB and Kindle. Book excerpt: More than 20 years of experience in molecular structure generation, from conceptualization through to applications Innovative, interdisciplinary text demonstrating example queries with software packages such as MOLGEN-online Detailed explanations on establishing QSPRs and QSARs as well as structure elucidation using mass spectrometry and structure generation. Aims and Scope This work provides an introduction to mathematical modeling of molecules and the resulting applications (structure generation, structure elucidation, QSAR/QSPR etc.). Most chemists have experimented with some software that represents molecules in an electronic form, and such models and applications are of increasing interest in diverse and growing fields such as drug discovery, environmental science and metabolomics. Furthermore, structure generation remains the only way to systematically create molecules that are not (yet) present in a database. This book starts with the mathematical theory behind representing molecules, explaining chemical concepts in mathematical terms and providing exercises that can be completed online. The later chapters cover applications of the theory, with detailed explanations on QSPR and QSAR investigations and finally structure elucidation combining mass spectrometry and structure generation. This book is aimed in particular at the users of structure generation methods and corresponding techniques, but also for those interested in teaching and learning mathematical chemistry, and for software designers in chemoinformatics.
Book Synopsis Contemporary Computer-Assisted Approaches to Molecular Structure Elucidation by : Mikhail E Elyashberg
Download or read book Contemporary Computer-Assisted Approaches to Molecular Structure Elucidation written by Mikhail E Elyashberg and published by Royal Society of Chemistry. This book was released on 2015-11-09 with total page 505 pages. Available in PDF, EPUB and Kindle. Book excerpt: Computer-Assisted Structure Elucidation (CASE) systems are a combination of software algorithms and tools to support and enable chemists and spectroscopists engaged in the process of molecular structure elucidation via the analysis of spectroscopic data. These expert systems dramatically reduce the time associated with structure elucidation and improve the reliability of the results. Contemporary Computer-Assisted Approaches to Molecular Structure Elucidation describes the principles on which these expert systems for spectroscopic structure elucidation are based and concisely explains the algorithmic concepts behind the programs. The authors use their own personal experiences in the development of the Structure Elucidator (StrucEluc) CASE software system to discuss the present state-of-the-art in computer-assisted structure elucidation. Scientists that are presently using CASE systems will be interested in the algorithms and modern approaches and for organizations that are currently using the StrucEluc platform the book is designed to help researchers understand the strategies behind CASE as well as details regarding the StrucEluc platform. For scientists that have never used CASE systems they will now have access to all necessary information to understand CASE systems for mastering this new and very effective approach to structure elucidation. The authors overall goal is writing this book is to produce the 'must read' definitive text that will represent the results of decades of work to develop computer-assisted structure elucidation software systems. CASE systems are now powerful software tools commonly outperforming and correcting human interpretations of data. This book will also provide an historical perspective of the work of the founding fathers of the technique and identify the challenges that have been overcome to produce modern CASE systems.
Book Synopsis Annual Review of Information Science and Technology by :
Download or read book Annual Review of Information Science and Technology written by and published by . This book was released on 1989 with total page 482 pages. Available in PDF, EPUB and Kindle. Book excerpt:
