Introduction to Practice of Molecular Simulation

Written By Akira Satoh
Introduction to Practice of Molecular Simulation
  • Publsiher : Elsevier
  • Release : 17 December 2010
  • ISBN : 0123851491
  • Pages : 330 pages
  • Rating : 4/5 from 21 reviews
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Read or download book entitled Introduction to Practice of Molecular Simulation written by Akira Satoh which was release on 17 December 2010, this book published by Elsevier. Available in PDF, EPUB and Kindle Format. Book excerpt: This book presents the most important and main concepts of the molecular and microsimulation techniques. It enables readers to improve their skills in developing simulation programs by providing physical problems and sample simulation programs for them to use. Provides tools to develop skills in developing simulations programs Includes sample simulation programs for the reader to use Appendix explains Fortran and C languages in simple terms to allow the non-expert to use them

Introduction to Practice of Molecular Simulation

Introduction to Practice of Molecular Simulation
  • Author : Akira Satoh
  • Publisher : Elsevier
  • Release Date : 2010-12-17
  • Total pages : 330
  • ISBN : 0123851491
GET BOOK

Summary : This book presents the most important and main concepts of the molecular and microsimulation techniques. It enables readers to improve their skills in developing simulation programs by providing physical problems and sample simulation programs for them to use. Provides tools to develop skills in developing simulations programs Includes sample simulation ...

Molecular Simulation of Fluids

Molecular Simulation of Fluids
  • Author : Sadus
  • Publisher : Elsevier
  • Release Date : 2022
  • Total pages : 212
  • ISBN : 0123851491
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Summary : Molecular simulation allows researchers unique insight into the structures and interactions at play in fluids. Since publication of the first edition of Molecular Simulation of Fluids, novel developments in theory, algorithms and computer hardware have generated enormous growth in simulation capabilities. This 2nd edition has been fully updated and expanded ...

Molecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio Lammps and Gromacs

Molecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio  Lammps and Gromacs
  • Author : Sumit Sharma
  • Publisher : Elsevier
  • Release Date : 2019-08-09
  • Total pages : 365
  • ISBN : 0123851491
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Summary : Molecular Dynamics Simulation of Nanocomposites using BIOVIA Materials Studio, Lammps and Gromacs presents the three major software packages used for the molecular dynamics simulation of nanocomposites. The book explains, in detail, how to use each of these packages, also providing real-world examples that show when each should be used. The ...

Molecular Materials with Specific Interactions Modeling and Design

Molecular Materials with Specific Interactions   Modeling and Design
  • Author : W. Andrzej Sokalski
  • Publisher : Springer Science & Business Media
  • Release Date : 2007-05-06
  • Total pages : 597
  • ISBN : 0123851491
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Summary : Design of new molecular materials is emerging as a new interdisciplinary research field. Corresponding reports are scattered in literature, and this book constitutes one of the first attempts to overview ongoing research efforts. It provides basic information, as well as the details of theory and examples of its application, to ...

The Chemistry and Physics of Engineering Materials

The Chemistry and Physics of Engineering Materials
  • Author : Alexandr A. Berlin,Roman Joswik,Nikolai I. Vatin
  • Publisher : CRC Press
  • Release Date : 2018-07-17
  • Total pages : 392
  • ISBN : 0123851491
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Summary : This new volume focuses on the limitations, properties, and models in the chemistry and physics of engineering materials that have potential for applications in several disciplines of engineering and science. Contributions range from new methods to novel applications of existing methods. The collection of topics in this volume reflects the ...

Mechanics of Particle and Fiber Reinforced Polymer Nanocomposites

Mechanics of Particle  and Fiber Reinforced Polymer Nanocomposites
  • Author : Sumit Sharma
  • Publisher : John Wiley & Sons
  • Release Date : 2021-03-03
  • Total pages : 320
  • ISBN : 0123851491
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Summary : Learn to model your own problems for predicting the properties of polymer-based composites Mechanics of Particle- and Fiber-Reinforced Polymer Nanocomposites: Nanoscale to Continuum Simulations provides readers with a thorough and up-to-date overview of nano, micro, and continuum approaches for the multiscale modeling of polymer-based composites. Covering nanocomposite development, theoretical models, ...

Computational Continuum Mechanics of Nanoscopic Structures

Computational Continuum Mechanics of Nanoscopic Structures
  • Author : Esmaeal Ghavanloo,Hashem Rafii-Tabar,Seyed Ahmad Fazelzadeh
  • Publisher : Springer
  • Release Date : 2019-02-19
  • Total pages : 275
  • ISBN : 0123851491
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Summary : This book offers a comprehensive treatment of nonlocal elasticity theory as applied to the prediction of the mechanical characteristics of various types of biological and non-biological nanoscopic structures with different morphologies and functional behaviour. It combines fundamental notions and advanced concepts, covering both the theory of nonlocal elasticity and the ...

Introduction to Zeolite Science and Practice

Introduction to Zeolite Science and Practice
  • Author : E.M. Flanigen,J.C. Jansen,Herman van Bekkum
  • Publisher : Elsevier
  • Release Date : 1991-02-05
  • Total pages : 753
  • ISBN : 0123851491
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Summary : Zeolites and related molecular sieves have quickly become important pathways to new opportunities in the fields of oil processing and petrochemical synthesis. The signs of intense activity in both industry and academia are evident: burgeoning papers and patent applications; increasing numbers of industrial zeolite-based processes and their rapid expansion into ...

Molecular Simulations

Molecular Simulations
  • Author : Saman Alavi
  • Publisher : John Wiley & Sons
  • Release Date : 2020-05-07
  • Total pages : 344
  • ISBN : 0123851491
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Summary : Provides hands-on knowledge enabling students of and researchers in chemistry, biology, and engineering to perform molecular simulations This book introduces the fundamentals of molecular simulations for a broad, practice-oriented audience and presents a thorough overview of the underlying concepts. It covers classical mechanics for many-molecule systems as well as force-field ...

Introduction to Zeolite Science and Practice

Introduction to Zeolite Science and Practice
  • Author : P.A. Jacobs,E.M. Flanigen,J.C. Jansen,Herman van Bekkum
  • Publisher : Elsevier
  • Release Date : 2001-06-26
  • Total pages : 1078
  • ISBN : 0123851491
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Summary : In view of the substantial progress made in the last decade in the fields of zeolites and related materials it was decided to go for an extended 2nd Edition of "Introduction to Zeolite Science and Practice". Unfortunately - as often is the case - this process took more time than ...

Chemical Engineering Process Simulation

Chemical Engineering Process Simulation
  • Author : Nishanth G. Chemmangattuvalappil,Denny Ng Kok Sum,Rafil Elyas,Cheng-Liang Chen,I Lung Chien,Hao-Yeh Lee,Rene D Elms
  • Publisher : Elsevier
  • Release Date : 2017-07-13
  • Total pages : 464
  • ISBN : 0123851491
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Summary : Chemical Engineering Process Simulation is ideal for students, early career researchers, and practitioners, as it guides you through chemical processes and unit operations using the main simulation softwares that are used in the industrial sector. This book will help you predict the characteristics of a process using mathematical models and ...

Molecular Docking and Molecular Dynamics

Molecular Docking and Molecular Dynamics
  • Author : Amalia Stefaniu
  • Publisher : BoD – Books on Demand
  • Release Date : 2019-12-18
  • Total pages : 100
  • ISBN : 0123851491
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Summary : This book clearly explains the principles of in silico tools of molecular docking and molecular dynamics. It provides examples of algorithms and procedures proposed by different software programs for visualizing and identifying potential interactions in complexes of biochemical interest. The book is structured in six chapters, each of which discusses ...

Molecular Simulation and Industrial Applications

Molecular Simulation and Industrial Applications
  • Author : Keith E. Gubbins,Nick Quirke
  • Publisher : Taylor & Francis
  • Release Date : 1996
  • Total pages : 537
  • ISBN : 0123851491
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Summary : First published in 2004. Routledge is an imprint of Taylor & Francis, an informa company....

An Introduction to Computational Physics

An Introduction to Computational Physics
  • Author : Tao Pang
  • Publisher : Cambridge University Press
  • Release Date : 2006-01-19
  • Total pages : 385
  • ISBN : 0123851491
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Summary : This advanced textbook provides an introduction to the basic methods of computational physics....

Introduction to Zeolite Molecular Sieves

Introduction to Zeolite Molecular Sieves
  • Author : Jiri Cejka,Herman van Bekkum,A. Corma,F. Schueth
  • Publisher : Elsevier
  • Release Date : 2007-10-02
  • Total pages : 1094
  • ISBN : 0123851491
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Summary : Introduction to Zeolite Molecular Sieves, 3rd Edition presents a collection of the most important results and ideas in the field of molecular sieve chemistry and technology, the most important experimental techniques related to the research activities in molecular sieves, and identifies new areas of molecular sieve chemistry. Chapters start at ...