Expert Systems in Chemistry Research

Expert Systems in Chemistry Research

Author: Markus C. Hemmer

Publisher: CRC Press

Published: 2007-12-13

Total Pages: 418

ISBN-13: 1420053248

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Expert systems allow scientists to access, manage, and apply data and specialized knowledge from various disciplines to their own research. Expert Systems in Chemistry Research explains the general scientific basis and computational principles behind expert systems and demonstrates how they can improve the efficiency of scientific workflows


Knowledge-based Expert Systems in Chemistry

Knowledge-based Expert Systems in Chemistry

Author: Philip Judson

Publisher: Royal Society of Chemistry

Published: 2009

Total Pages: 223

ISBN-13: 0854041605

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This book is about the development of knowledge-based, and related, expert systems in chemistry and toxicology. It shows how computers can work with qualitative information where precise numerical methods are not satisfactory.


Machine Learning in Chemistry

Machine Learning in Chemistry

Author: Edward O. Pyzer-Knapp

Publisher:

Published: 2020-10-22

Total Pages: 140

ISBN-13: 9780841235052

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Atomic-scale representation and statistical learning of tensorial properties -- Prediction of Mohs hardness with machine learning methods using compositional features -- High-dimensional neural network potentials for atomistic simulations -- Data-driven learning systems for chemical reaction prediction: an analysis of recent approaches -- Using machine learning to inform decisions in drug discovery : an industry perspective -- Cognitive materials discovery and onset of the 5th discovery paradigm.


Expert Systems In Developing Countries

Expert Systems In Developing Countries

Author: Charles K. Mann

Publisher: CRC Press

Published: 2019-03-07

Total Pages: 298

ISBN-13: 0429695306

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This book focuses on the pioneering applications of an expert system in development relate to agriculture in many of the developing countries, introducing the reader to some of the key concepts underlying most expert systems.


Artificial Intelligence in Chemical Engineering

Artificial Intelligence in Chemical Engineering

Author: Thomas E. Quantrille

Publisher: Elsevier

Published: 2012-12-02

Total Pages: 634

ISBN-13: 0080571212

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Artificial intelligence (AI) is the part of computer science concerned with designing intelligent computer systems (systems that exhibit characteristics we associate with intelligence in human behavior). This book is the first published textbook of AI in chemical engineering, and provides broad and in-depth coverage of AI programming, AI principles, expert systems, and neural networks in chemical engineering. This book introduces the computational means and methodologies that are used to enable computers to perform intelligent engineering tasks. A key goal is to move beyond the principles of AI into its applications in chemical engineering. After reading this book, a chemical engineer will have a firm grounding in AI, know what chemical engineering applications of AI exist today, and understand the current challenges facing AI in engineering. - Allows the reader to learn AI quickly using inexpensive personal computers - Contains a large number of illustrative examples, simple exercises, and complex practice problems and solutions - Includes a computer diskette for an illustrated case study - Demonstrates an expert system for separation synthesis (EXSEP) - Presents a detailed review of published literature on expert systems and neural networks in chemical engineering


Probabilistic Networks and Expert Systems

Probabilistic Networks and Expert Systems

Author: Robert G. Cowell

Publisher: Springer Science & Business Media

Published: 2007-07-16

Total Pages: 340

ISBN-13: 9780387718231

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Probabilistic expert systems are graphical networks which support the modeling of uncertainty and decisions in large complex domains, while retaining ease of calculation. Building on original research by the authors, this book gives a thorough and rigorous mathematical treatment of the underlying ideas, structures, and algorithms. The book will be of interest to researchers in both artificial intelligence and statistics, who desire an introduction to this fascinating and rapidly developing field. The book, winner of the DeGroot Prize 2002, the only book prize in the field of statistics, is new in paperback.


27th European Symposium on Computer Aided Process Engineering

27th European Symposium on Computer Aided Process Engineering

Author:

Publisher: Elsevier

Published: 2017-09-21

Total Pages: 3064

ISBN-13: 0444639705

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27th European Symposium on Computer Aided Process Engineering, Volume 40 contains the papers presented at the 27th European Society of Computer-Aided Process Engineering (ESCAPE) event held in Barcelona, October 1-5, 2017. It is a valuable resource for chemical engineers, chemical process engineers, researchers in industry and academia, students, and consultants for chemical industries. - Presents findings and discussions from the 27th European Society of Computer-Aided Process Engineering (ESCAPE) event


Scientific and Technical Aerospace Reports

Scientific and Technical Aerospace Reports

Author:

Publisher:

Published: 1995

Total Pages: 380

ISBN-13:

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Lists citations with abstracts for aerospace related reports obtained from world wide sources and announces documents that have recently been entered into the NASA Scientific and Technical Information Database.


Computer Chemistry

Computer Chemistry

Author: Mario Marsili

Publisher: CRC Press

Published: 2017-07-28

Total Pages: 208

ISBN-13: 1351367463

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Computer Chemistry illustrates the methods and philosophies of how a computer can be instructed to "understand" chemical facts, formulas and rules. It focuses on discussions of all of the major sections in both theoretical framework and practical application through examples. It includes the Synthesis Design Systems for the simulation of chemical reactions, the Structure Elucidation Systems for the interpretation of spectral data, the Molecular Modelling Systems for the visualization of chemical structures and the calculation of physico-chemical parameters.