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Application Of Optimization Algorithms In Chemistry
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Book Synopsis Application of Optimization Algorithms in Chemistry by : Jorge M. C. Marques
Download or read book Application of Optimization Algorithms in Chemistry written by Jorge M. C. Marques and published by Frontiers Media SA. This book was released on 2020-06-08 with total page 145 pages. Available in PDF, EPUB and Kindle. Book excerpt: This eBook is dedicated to Prof. William L. Hase, who passed away on Monday, March 23, 2020.
Book Synopsis Optimization in Chemical Engineering by : Suman Dutta
Download or read book Optimization in Chemical Engineering written by Suman Dutta and published by Cambridge University Press. This book was released on 2016-03-11 with total page 384 pages. Available in PDF, EPUB and Kindle. Book excerpt: Optimization is used to determine the most appropriate value of variables under given conditions. The primary focus of using optimisation techniques is to measure the maximum or minimum value of a function depending on the circumstances. This book discusses problem formulation and problem solving with the help of algorithms such as secant method, quasi-Newton method, linear programming and dynamic programming. It also explains important chemical processes such as fluid flow systems, heat exchangers, chemical reactors and distillation systems using solved examples. The book begins by explaining the fundamental concepts followed by an elucidation of various modern techniques including trust-region methods, Levenberg–Marquardt algorithms, stochastic optimization, simulated annealing and statistical optimization. It studies the multi-objective optimization technique and its applications in chemical engineering and also discusses the theory and applications of various optimization software tools including LINGO, MATLAB, MINITAB and GAMS.
Book Synopsis Multi-Objective Optimization by : Gade Pandu Rangaiah
Download or read book Multi-Objective Optimization written by Gade Pandu Rangaiah and published by World Scientific. This book was released on 2009 with total page 454 pages. Available in PDF, EPUB and Kindle. Book excerpt: Optimization has been playing a key role in the design, planning and operation of chemical and related processes for nearly half a century. Although process optimization for multiple objectives was studied by several researchers back in the 1970s and 1980s, it has attracted active research in the last 10 years, spurred by the new and effective techniques for multi-objective optimization. In order to capture this renewed interest, this monograph presents the recent and ongoing research in multi-optimization techniques and their applications in chemical engineering. Following a brief introduction and general review on the development of multi-objective optimization applications in chemical engineering since 2000, the book gives a description of selected multi-objective techniques and then goes on to discuss chemical engineering applications. These applications are from diverse areas within chemical engineering, and are presented in detail. All chapters will be of interest to researchers in multi-objective optimization and/or chemical engineering; they can be read individually and used in one''s learning and research. Several exercises are included at the end of many chapters, for use by both practicing engineers and students.
Book Synopsis Nonlinear Programming by : Lorenz T. Biegler
Download or read book Nonlinear Programming written by Lorenz T. Biegler and published by SIAM. This book was released on 2010-01-01 with total page 411 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book addresses modern nonlinear programming (NLP) concepts and algorithms, especially as they apply to challenging applications in chemical process engineering. The author provides a firm grounding in fundamental NLP properties and algorithms, and relates them to real-world problem classes in process optimization, thus making the material understandable and useful to chemical engineers and experts in mathematical optimization.
Book Synopsis Multi-Objective Optimization in Chemical Engineering by : Gade Pandu Rangaiah
Download or read book Multi-Objective Optimization in Chemical Engineering written by Gade Pandu Rangaiah and published by John Wiley & Sons. This book was released on 2013-03-20 with total page 487 pages. Available in PDF, EPUB and Kindle. Book excerpt: For reasons both financial and environmental, there is a perpetual need to optimize the design and operating conditions of industrial process systems in order to improve their performance, energy efficiency, profitability, safety and reliability. However, with most chemical engineering application problems having many variables with complex inter-relationships, meeting these optimization objectives can be challenging. This is where Multi-Objective Optimization (MOO) is useful to find the optimal trade-offs among two or more conflicting objectives. This book provides an overview of the recent developments and applications of MOO for modeling, design and operation of chemical, petrochemical, pharmaceutical, energy and related processes. It then covers important theoretical and computational developments as well as specific applications such as metabolic reaction networks, chromatographic systems, CO2 emissions targeting for petroleum refining units, ecodesign of chemical processes, ethanol purification and cumene process design. Multi-Objective Optimization in Chemical Engineering: Developments and Applications is an invaluable resource for researchers and graduate students in chemical engineering as well as industrial practitioners and engineers involved in process design, modeling and optimization.
Author :Christodoulos A. Floudas Publisher :Springer Science & Business Media ISBN 13 :147573218X Total Pages :341 pages Book Rating :4.4/5 (757 download)
Book Synopsis Optimization in Computational Chemistry and Molecular Biology by : Christodoulos A. Floudas
Download or read book Optimization in Computational Chemistry and Molecular Biology written by Christodoulos A. Floudas and published by Springer Science & Business Media. This book was released on 2013-06-29 with total page 341 pages. Available in PDF, EPUB and Kindle. Book excerpt: Optimization in Computational Chemistry and Molecular Biology: Local and Global Approaches covers recent developments in optimization techniques for addressing several computational chemistry and biology problems. A tantalizing problem that cuts across the fields of computational chemistry, biology, medicine, engineering and applied mathematics is how proteins fold. Global and local optimization provide a systematic framework of conformational searches for the prediction of three-dimensional protein structures that represent the global minimum free energy, as well as low-energy biomolecular conformations. Each contribution in the book is essentially expository in nature, but of scholarly treatment. The topics covered include advances in local and global optimization approaches for molecular dynamics and modeling, distance geometry, protein folding, molecular structure refinement, protein and drug design, and molecular and peptide docking. Audience: The book is addressed not only to researchers in mathematical programming, but to all scientists in various disciplines who use optimization methods in solving problems in computational chemistry and biology.
Author :Christodoulos A. Floudas Publisher :Springer Science & Business Media ISBN 13 :1461334373 Total Pages :638 pages Book Rating :4.4/5 (613 download)
Book Synopsis State of the Art in Global Optimization by : Christodoulos A. Floudas
Download or read book State of the Art in Global Optimization written by Christodoulos A. Floudas and published by Springer Science & Business Media. This book was released on 2013-12-01 with total page 638 pages. Available in PDF, EPUB and Kindle. Book excerpt: Optimization problems abound in most fields of science, engineering, and tech nology. In many of these problems it is necessary to compute the global optimum (or a good approximation) of a multivariable function. The variables that define the function to be optimized can be continuous and/or discrete and, in addition, many times satisfy certain constraints. Global optimization problems belong to the complexity class of NP-hard prob lems. Such problems are very difficult to solve. Traditional descent optimization algorithms based on local information are not adequate for solving these problems. In most cases of practical interest the number of local optima increases, on the aver age, exponentially with the size of the problem (number of variables). Furthermore, most of the traditional approaches fail to escape from a local optimum in order to continue the search for the global solution. Global optimization has received a lot of attention in the past ten years, due to the success of new algorithms for solving large classes of problems from diverse areas such as engineering design and control, computational chemistry and biology, structural optimization, computer science, operations research, and economics. This book contains refereed invited papers presented at the conference on "State of the Art in Global Optimization: Computational Methods and Applications" held at Princeton University, April 28-30, 1995. The conference presented current re search on global optimization and related applications in science and engineering. The papers included in this book cover a wide spectrum of approaches for solving global optimization problems and applications.
Author :Christodoulos A. Floudas Publisher :Springer Science & Business Media ISBN 13 :9780792360148 Total Pages :774 pages Book Rating :4.3/5 (61 download)
Book Synopsis Deterministic Global Optimization by : Christodoulos A. Floudas
Download or read book Deterministic Global Optimization written by Christodoulos A. Floudas and published by Springer Science & Business Media. This book was released on 2000 with total page 774 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book provides a unified and insightful treatment of deterministic global optimization. It introduces theoretical and algorithmic advances that address the computation and characterization of global optima, determine valid lower and upper bounds on the global minima and maxima, and enclose all solutions of nonlinear constrained systems of equations. Among its special features, the book: Introduces the fundamentals of deterministic global optimization; Provides a thorough treatment of decomposition-based global optimization approaches for biconvex and bilinear problems; Covers global optimization methods for generalized geometric programming problems Presents in-depth global optimization algorithms for general twice continuously differentiable nonlinear problems; Provides a detailed treatment of global optimization methods for mixed-integer nonlinear problems; Develops global optimization approaches for the enclosure of all solutions of nonlinear constrained systems of equations; Includes many important applications from process design, synthesis, control, and operations, phase equilibrium, design under uncertainty, parameter estimation, azeotrope prediction, structure prediction in clusters and molecules, protein folding, and peptide docking. Audience: This book can be used as a textbook in graduate-level courses and as a desk reference for researchers in all branches of engineering and applied science, applied mathematics, industrial engineering, operations research, computer science, economics, computational chemistry and molecular biology.
Book Synopsis Meta-heuristic Optimization Techniques by : Anuj Kumar
Download or read book Meta-heuristic Optimization Techniques written by Anuj Kumar and published by Walter de Gruyter GmbH & Co KG. This book was released on 2022-01-19 with total page 219 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book offers a thorough overview of the most popular and researched meta-heuristic optimization techniques and nature-inspired algorithms. Their wide applicability makes them a hot research topic and an effi cient tool for the solution of complex optimization problems in various fi elds of sciences, engineering, and in numerous industries.
Book Synopsis Handbook of Research on Emergent Applications of Optimization Algorithms by : Vasant, Pandian
Download or read book Handbook of Research on Emergent Applications of Optimization Algorithms written by Vasant, Pandian and published by IGI Global. This book was released on 2017-10-31 with total page 948 pages. Available in PDF, EPUB and Kindle. Book excerpt: Modern optimization approaches have attracted an increasing number of scientists, decision makers, and researchers. As new issues in this field emerge, different optimization methodologies must be developed and implemented. The Handbook of Research on Emergent Applications of Optimization Algorithms is an authoritative reference source for the latest scholarly research on modern optimization techniques for solving complex problems of global optimization and their applications in economics and engineering. Featuring coverage on a broad range of topics and perspectives such as hybrid systems, non-cooperative games, and cryptography, this publication is ideally designed for students, researchers, and engineers interested in emerging developments in optimization algorithms.
Book Synopsis Chemical Process Retrofitting and Revamping by : Gade Pandu Rangaiah
Download or read book Chemical Process Retrofitting and Revamping written by Gade Pandu Rangaiah and published by John Wiley & Sons. This book was released on 2016-01-29 with total page 432 pages. Available in PDF, EPUB and Kindle. Book excerpt: The proposed book will be divided into three parts. The chapters in Part I provide an overview of certain aspect of process retrofitting. The focus of Part II is on computational techniques for solving process retrofit problems. Finally, Part III addresses retrofit applications from diverse process industries. Some chapters in the book are contributed by practitioners whereas others are from academia. Hence, the book includes both new developments from research and also practical considerations. Many chapters include examples with realistic data. All these feature make the book useful to industrial engineers, researchers and students.
Book Synopsis Nature-Inspired Optimization Algorithms by : Xin-She Yang
Download or read book Nature-Inspired Optimization Algorithms written by Xin-She Yang and published by Elsevier. This book was released on 2014-02-17 with total page 277 pages. Available in PDF, EPUB and Kindle. Book excerpt: Nature-Inspired Optimization Algorithms provides a systematic introduction to all major nature-inspired algorithms for optimization. The book's unified approach, balancing algorithm introduction, theoretical background and practical implementation, complements extensive literature with well-chosen case studies to illustrate how these algorithms work. Topics include particle swarm optimization, ant and bee algorithms, simulated annealing, cuckoo search, firefly algorithm, bat algorithm, flower algorithm, harmony search, algorithm analysis, constraint handling, hybrid methods, parameter tuning and control, as well as multi-objective optimization. This book can serve as an introductory book for graduates, doctoral students and lecturers in computer science, engineering and natural sciences. It can also serve a source of inspiration for new applications. Researchers and engineers as well as experienced experts will also find it a handy reference. - Discusses and summarizes the latest developments in nature-inspired algorithms with comprehensive, timely literature - Provides a theoretical understanding as well as practical implementation hints - Provides a step-by-step introduction to each algorithm
Book Synopsis Computer Aided Molecular Design by : Luke Achenie
Download or read book Computer Aided Molecular Design written by Luke Achenie and published by Elsevier. This book was released on 2002-11-20 with total page 405 pages. Available in PDF, EPUB and Kindle. Book excerpt: CAMD or Computer Aided Molecular Design refers to the design of molecules with desirable properties. That is, through CAMD, one determines molecules that match a specified set of (target) properties. CAMD as a technique has a very large potential as in principle, all kinds of chemical, bio-chemical and material products can be designed through this technique.This book mainly deals with macroscopic properties and therefore does not cover molecular design of large, complex chemicals such as drugs. While books have been written on computer aided molecular design relating to drugs and large complex chemicals, a book on systematic formulation of CAMD problems and solutions, with emphasis on theory and practice, which helps one to learn, understand and apply the technique is currently unavailable.·This title brings together the theoretical aspects related to Computer Aided Molecular Design, the different techniques that have been developed and the different applications that have been reported. ·Contributing authors are among the leading researchers and users of CAMD·First book available giving a systematic formulation of CAMD problems and solutions
Book Synopsis Nonlinear and Mixed-Integer Optimization by : Christodoulos A. Floudas
Download or read book Nonlinear and Mixed-Integer Optimization written by Christodoulos A. Floudas and published by Oxford University Press. This book was released on 1995-10-05 with total page 475 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume presents the fundamentals of nonlinear and mixed-integer optimisation, and their applications in the important area of process synthesis in chemical engineering. Topics that are unique include the theory and methods for mixed-integer nonlinear optimisation, introduction to modelling issues in process synthesis, and optimisation-based approaches in the synthesis of heat recovery systems, distillation-based systems, and reactor-based systems.
Book Synopsis Chemical Product Design by : E. L. Cussler
Download or read book Chemical Product Design written by E. L. Cussler and published by Cambridge University Press. This book was released on 2001-04-16 with total page 152 pages. Available in PDF, EPUB and Kindle. Book excerpt: Until recently, the chemical industry has been dominated by the manufacture of bulk commodity chemicals such as benzene, ammonia, and polypropylene. However, over the last decade a significant shift occurred. Now most chemical companies devote any new resources to the design and manufacture of specialty, high value-added chemical products such as pharmaceuticals, cosmetics, and electronic coatings. Although the jobs held by chemical engineers have also changed to reflect this altered business, their training has remained static, emphasizing traditional commodities. This ground-breaking text starts to redress the balance between commodities and higher value-added products. It expands the scope of chemical engineering design to encompass both process design and product design. The authors use a four-step procedure for chemical product design - needs, ideas, selection, manufacture - drawing numerous examples from industry to illustrate the discussion. The book concludes with a brief review of the economic issues. Chemical engineering students and beginning chemical engineers will find this text an inviting introduction to chemical product design.
Book Synopsis Optimization Techniques and Applications with Examples by : Xin-She Yang
Download or read book Optimization Techniques and Applications with Examples written by Xin-She Yang and published by John Wiley & Sons. This book was released on 2018-09-19 with total page 384 pages. Available in PDF, EPUB and Kindle. Book excerpt: A guide to modern optimization applications and techniques in newly emerging areas spanning optimization, data science, machine intelligence, engineering, and computer sciences Optimization Techniques and Applications with Examples introduces the fundamentals of all the commonly used techniques in optimization that encompass the broadness and diversity of the methods (traditional and new) and algorithms. The author—a noted expert in the field—covers a wide range of topics including mathematical foundations, optimization formulation, optimality conditions, algorithmic complexity, linear programming, convex optimization, and integer programming. In addition, the book discusses artificial neural network, clustering and classifications, constraint-handling, queueing theory, support vector machine and multi-objective optimization, evolutionary computation, nature-inspired algorithms and many other topics. Designed as a practical resource, all topics are explained in detail with step-by-step examples to show how each method works. The book’s exercises test the acquired knowledge that can be potentially applied to real problem solving. By taking an informal approach to the subject, the author helps readers to rapidly acquire the basic knowledge in optimization, operational research, and applied data mining. This important resource: Offers an accessible and state-of-the-art introduction to the main optimization techniques Contains both traditional optimization techniques and the most current algorithms and swarm intelligence-based techniques Presents a balance of theory, algorithms, and implementation Includes more than 100 worked examples with step-by-step explanations Written for upper undergraduates and graduates in a standard course on optimization, operations research and data mining, Optimization Techniques and Applications with Examples is a highly accessible guide to understanding the fundamentals of all the commonly used techniques in optimization.
Book Synopsis Swarm Intelligence Optimization by : Abhishek Kumar
Download or read book Swarm Intelligence Optimization written by Abhishek Kumar and published by John Wiley & Sons. This book was released on 2021-01-07 with total page 384 pages. Available in PDF, EPUB and Kindle. Book excerpt: Resource optimization has always been a thrust area of research, and as the Internet of Things (IoT) is the most talked about topic of the current era of technology, it has become the need of the hour. Therefore, the idea behind this book was to simplify the journey of those who aspire to understand resource optimization in the IoT. To this end, included in this book are various real-time/offline applications and algorithms/case studies in the fields of engineering, computer science, information security, and cloud computing, along with the modern tools and various technologies used in systems, leaving the reader with a high level of understanding of various techniques and algorithms used in resource optimization.