A Practical Introduction to the Simulation of Molecular Systems

A Practical Introduction to the Simulation of Molecular Systems PDF

Author: Martin J. Field

Publisher: Cambridge University Press

Published: 2007-07-19

Total Pages: 294

ISBN-13: 1139465813

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Molecular simulation is a powerful tool in materials science, physics, chemistry and biomolecular fields. This updated edition provides a pragmatic introduction to a wide range of techniques for the simulation of molecular systems at the atomic level. The first part concentrates on methods for calculating the potential energy of a molecular system, with new chapters on quantum chemical, molecular mechanical and hybrid potential techniques. The second part describes methods examining conformational, dynamical and thermodynamical properties of systems, covering techniques including geometry-optimization, normal-mode analysis, molecular dynamics, and Monte Carlo simulation. Using Python, the second edition includes numerous examples and program modules for each simulation technique, allowing the reader to perform the calculations and appreciate the inherent difficulties involved in each. This is a valuable resource for researchers and graduate students wanting to know how to use atomic-scale molecular simulations. Supplementary material, including the program library and technical information, available through www.cambridge.org/9780521852524.

Creating Computer Simulation Systems

Creating Computer Simulation Systems PDF

Author: Dr. Frederick Kuhl

Publisher: Prentice Hall

Published: 2000

Total Pages: 248

ISBN-13:

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This book is an introduction to the High Level Architecture for modeling and simulation. The HLA is a software architecture for creating computer models and simulation out of component models or simulations. HLA was adopted by the US Defense Dept. The book is an introduction to HLA for application developers.

Parallel and Distributed Simulation Systems

Parallel and Distributed Simulation Systems PDF

Author: Richard M. Fujimoto

Publisher: Wiley-Interscience

Published: 2000-01-03

Total Pages: 324

ISBN-13:

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A state-of-the-art guide for the implementation of distributed simulation technology. The rapid expansion of the Internet and commodity parallel computers has made parallel and distributed simulation (PADS) a hot technology indeed. Applications abound not only in the analysis of complex systems such as transportation or the next-generation Internet, but also in computer-generated virtual worlds for military and professional training, interactive computer games, and the entertainment industry. In this book, PADS expert Richard M. Fujimoto provides software developers with cutting-edge techniques for speeding up the execution of simulations across multiple processors and dealing with data distribution over wide area networks ,including the Internet. With an emphasis on parallel and distributed discrete event simulation technologies, Dr. Fujimoto compiles and consolidates research results in the field spanning the last twenty years, discussing the use of parallel and distributed computers in both the modeling and analysis of system behavior and the creation of distributed virtual environments. While other books on PADS concentrate on applications, Parallel and Distributed Simulation Systems clearly shows how to implement the technology. It explains in detail the synchronization algorithms needed to properly realize the simulations, including an in-depth discussion of time warp and advanced optimistic techniques. Finally, the book is richly supplemented with references, tables and illustrations, and examples of contemporary systems such as the Department of Defense's High Level Architecture (HLA), which has become the standard architecture for defense programs in the United States.

Continuous System Simulation

Continuous System Simulation PDF

Author: François E. Cellier

Publisher: Springer Science & Business Media

Published: 2006-06-03

Total Pages: 659

ISBN-13: 0387302603

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Highly computer-oriented text, introducing numerical methods and algorithms along with the applications and conceptual tools. Includes homework problems, suggestions for research projects, and open-ended questions at the end of each chapter. Written by our successful author who also wrote Continuous System Modeling, a best-selling Springer book first published in the 1991 (sold about 1500 copies).

Guide to Modeling and Simulation of Systems of Systems

Guide to Modeling and Simulation of Systems of Systems PDF

Author: Bernard Zeigler

Publisher: Springer Science & Business Media

Published: 2012-10-22

Total Pages: 50

ISBN-13: 1447145704

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This user’s reference is a companion to the separate book also titled “Guide to Modelling and Simulation of Systems of Systems.” The principal book explicates integrated development environments to support virtual building and testing of systems of systems, covering in some depth the MS4 Modelling EnvironmentTM. This user’s reference provides a quick reference and exposition of the various concepts and functional features covered in that book. The topics in the user’s reference are grouped in alignment with the workflow displayed on the MS4 Modeling EnvironmentTM launch page, under the headings Atomic Models, System Entity Structure, Pruning SES, and Miscellaneous. For each feature, the reference discusses why we use it, when we should use it, and how to use it. Further comments and links to related features are also included.

Simulation of Dynamic Systems with MATLAB® and Simulink®

Simulation of Dynamic Systems with MATLAB® and Simulink® PDF

Author: Harold Klee

Publisher: CRC Press

Published: 2018-02-02

Total Pages: 852

ISBN-13: 1498787789

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Continuous-system simulation is an increasingly important tool for optimizing the performance of real-world systems. The book presents an integrated treatment of continuous simulation with all the background and essential prerequisites in one setting. It features updated chapters and two new sections on Black Swan and the Stochastic Information Packet (SIP) and Stochastic Library Units with Relationships Preserved (SLURP) Standard. The new edition includes basic concepts, mathematical tools, and the common principles of various simulation models for different phenomena, as well as an abundance of case studies, real-world examples, homework problems, and equations to develop a practical understanding of concepts.

System Design, Modeling, and Simulation

System Design, Modeling, and Simulation PDF

Author: Claudius Ptolemaeus

Publisher: Lee & Seshia

Published: 2013-09-27

Total Pages: 687

ISBN-13: 1304421066

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This book is a definitive introduction to models of computation for the design of complex, heterogeneous systems. It has a particular focus on cyber-physical systems, which integrate computing, networking, and physical dynamics. The book captures more than twenty years of experience in the Ptolemy Project at UC Berkeley, which pioneered many design, modeling, and simulation techniques that are now in widespread use. All of the methods covered in the book are realized in the open source Ptolemy II modeling framework and are available for experimentation through links provided in the book. The book is suitable for engineers, scientists, researchers, and managers who wish to understand the rich possibilities offered by modern modeling techniques. The goal of the book is to equip the reader with a breadth of experience that will help in understanding the role that such techniques can play in design.

Modeling and Simulation of Discrete Event Systems

Modeling and Simulation of Discrete Event Systems PDF

Author: Byoung Kyu Choi

Publisher: John Wiley & Sons

Published: 2013-08-07

Total Pages: 427

ISBN-13: 1118732855

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Computer modeling and simulation (M&S) allows engineers to study and analyze complex systems. Discrete-event system (DES)-M&S is used in modern management, industrial engineering, computer science, and the military. As computer speeds and memory capacity increase, so DES-M&S tools become more powerful and more widely used in solving real-life problems. Based on over 20 years of evolution within a classroom environment, as well as on decades-long experience in developing simulation-based solutions for high-tech industries, Modeling and Simulation of Discrete-Event Systems is the only book on DES-M&S in which all the major DES modeling formalisms – activity-based, process-oriented, state-based, and event-based – are covered in a unified manner: A well-defined procedure for building a formal model in the form of event graph, ACD, or state graph Diverse types of modeling templates and examples that can be used as building blocks for a complex, real-life model A systematic, easy-to-follow procedure combined with sample C# codes for developing simulators in various modeling formalisms Simple tutorials as well as sample model files for using popular off-the-shelf simulators such as SIGMA®, ACE®, and Arena® Up-to-date research results as well as research issues and directions in DES-M&S Modeling and Simulation of Discrete-Event Systems is an ideal textbook for undergraduate and graduate students of simulation/industrial engineering and computer science, as well as for simulation practitioners and researchers.

Modeling and Simulation in the Systems Engineering Life Cycle

Modeling and Simulation in the Systems Engineering Life Cycle PDF

Author: Margaret L. Loper

Publisher: Springer

Published: 2015-04-30

Total Pages: 405

ISBN-13: 144715634X

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This easy to read text provides a broad introduction to the fundamental concepts of modeling and simulation (M&S) and systems engineering, highlighting how M&S is used across the entire systems engineering lifecycle. Features: reviews the full breadth of technologies, methodologies and uses of M&S, rather than just focusing on a specific aspect of the field; presents contributions from specialists in each topic covered; introduces the foundational elements and processes that serve as the groundwork for understanding M&S; explores common methods and methodologies used in M&S; discusses how best to design and execute experiments, covering the use of Monte Carlo techniques, surrogate modeling and distributed simulation; explores the use of M&S throughout the systems development lifecycle, describing a number of methods, techniques, and tools available to support systems engineering processes; provides a selection of case studies illustrating the use of M&S in systems engineering across a variety of domains.

Guide to Dynamic Simulations of Rigid Bodies and Particle Systems

Guide to Dynamic Simulations of Rigid Bodies and Particle Systems PDF

Author: Murilo G. Coutinho

Publisher: Springer Science & Business Media

Published: 2012-10-08

Total Pages: 402

ISBN-13: 1447144171

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This book introduces the techniques needed to produce realistic simulations and animations of particle and rigid-body systems. The text focuses on both the theoretical and practical aspects of developing and implementing physically based dynamic-simulation engines. Each chapter examines numerous algorithms, describing their design and analysis in an accessible manner, without sacrificing depth of coverage or mathematical rigor. Features: examines the problem of computing an hierarchical representation of the geometric description of each simulated object, as well as the simulated world; discusses the use of discrete and continuous collision detection to handle thin or fast-moving objects; describes the computational techniques needed for determining all impulsive and contact forces between bodies with multiple simultaneous collisions and contacts; presents techniques that can be used to dynamically simulate articulated rigid bodies; concludes each chapter with exercises.