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Book Amber 2021

    Book Details:
  • Author : David A. Case
  • Publisher : University of California, San Francisco
  • Release : 2021-06-13
  • ISBN :
  • Pages : 959 pages

Download or read book Amber 2021 written by David A. Case and published by University of California, San Francisco. This book was released on 2021-06-13 with total page 959 pages. Available in PDF, EPUB and Kindle. Book excerpt: Amber is the collective name for a suite of programs that allow users to carry out molecular dynamics simulations, particularly on biomolecules. None of the individual programs carries this name, but the various parts work reasonably well together, and provide a powerful framework for many common calculations. The term Amber is also used to refer to the empirical force fields that are implemented here. It should be recognized, however, that the code and force field are separate: several other computer packages have implemented the Amber force fields, and other force fields can be implemented with the Amber programs. Further, the force fields are in the public domain, whereas the codes are distributed under a license agreement. The Amber software suite is divided into two parts: AmberTools21, a collection of freely available programs mostly under the GPL license, and Amber20, which is centered around the pmemd simulation program, and which continues to be licensed as before, under a more restrictive license. Amber20 represents a significant change from the most recent previous version, Amber18. (We have moved to numbering Amber releases by the last two digits of the calendar year, so there are no odd-numbered versions.) Please see https://ambermd.org for an overview of the most important changes. AmberTools is a set of programs for biomolecular simulation and analysis. They are designed to work well with each other, and with the “regular” Amber suite of programs. You can perform many simulation tasks with AmberTools, and you can do more extensive simulations with the combination of AmberTools and Amber itself. Most components of AmberTools are released under the GNU General Public License (GPL). A few components are in the public domain or have other open-source licenses. See the README file for more information.

Book Unsteady Computational Fluid Dynamics in Aeronautics

Download or read book Unsteady Computational Fluid Dynamics in Aeronautics written by P.G. Tucker and published by Springer Science & Business Media. This book was released on 2013-08-30 with total page 432 pages. Available in PDF, EPUB and Kindle. Book excerpt: The field of Large Eddy Simulation (LES) and hybrids is a vibrant research area. This book runs through all the potential unsteady modelling fidelity ranges, from low-order to LES. The latter is probably the highest fidelity for practical aerospace systems modelling. Cutting edge new frontiers are defined. One example of a pressing environmental concern is noise. For the accurate prediction of this, unsteady modelling is needed. Hence computational aeroacoustics is explored. It is also emerging that there is a critical need for coupled simulations. Hence, this area is also considered and the tensions of utilizing such simulations with the already expensive LES. This work has relevance to the general field of CFD and LES and to a wide variety of non-aerospace aerodynamic systems (e.g. cars, submarines, ships, electronics, buildings). Topics treated include unsteady flow techniques; LES and hybrids; general numerical methods; computational aeroacoustics; computational aeroelasticity; coupled simulations and turbulence and its modelling (LES, RANS, transition, VLES, URANS). The volume concludes by pointing forward to future horizons and in particular the industrial use of LES. The writing style is accessible and useful to both academics and industrial practitioners. From the reviews: "Tucker's volume provides a very welcome, concise discussion of current capabilities for simulating and modellng unsteady aerodynamic flows. It covers the various pos sible numerical techniques in good, clear detail and presents a very wide range of practical applications; beautifully illustrated in many cases. This book thus provides a valuable text for practicing engineers, a rich source of background information for students and those new to this area of Research & Development, and an excellent state-of-the-art review for others. A great achievement." Mark Savill FHEA, FRAeS, C.Eng, Professor of Computational Aerodynamics Design & Head of Power & Propulsion Sciences, Department of Power & Propulsion, School of Engineering, Cranfield University, Bedfordshire, U.K. "This is a very useful book with a wide coverage of many aspects in unsteady aerodynamics method development and applications for internal and external flows." L. He, Rolls-Royce/RAEng Chair of Computational Aerothermal Engineering, Oxford University, U.K. "This comprehensive book ranges from classical concepts in both numerical methods and turbulence modelling approaches for the beginner to latest state-of-the-art for the advanced practitioner and constitutes an extremely valuable contribution to the specific Computational Fluid Dynamics literature in Aeronautics. Student and expert alike will benefit greatly by reading it from cover to cover." Sébastien Deck, Onera, Meudon, France

Book Computational Fluid and Solid Mechanics 2003

Download or read book Computational Fluid and Solid Mechanics 2003 written by K.J Bathe and published by Elsevier. This book was released on 2003-06-02 with total page 2485 pages. Available in PDF, EPUB and Kindle. Book excerpt: Bringing together the world's leading researchers and practitioners of computational mechanics, these new volumes meet and build on the eight key challenges for research and development in computational mechanics. Researchers have recently identified eight critical research tasks facing the field of computational mechanics. These tasks have come about because it appears possible to reach a new level of mathematical modelling and numerical solution that will lead to a much deeper understanding of nature and to great improvements in engineering design.The eight tasks are: The automatic solution of mathematical models Effective numerical schemes for fluid flows The development of an effective mesh-free numerical solution method The development of numerical procedures for multiphysics problems The development of numerical procedures for multiscale problems The modelling of uncertainties The analysis of complete life cycles of systems Education - teaching sound engineering and scientific judgement Readers of Computational Fluid and Solid Mechanics 2003 will be able to apply the combined experience of many of the world's leading researchers to their own research needs. Those in academic environments will gain a better insight into the needs and constraints of the industries they are involved with; those in industry will gain a competitive advantage by gaining insight into the cutting edge research being carried out by colleagues in academia. Features Bridges the gap between academic researchers and practitioners in industry Outlines the eight main challenges facing Research and Design in Computational mechanics and offers new insights into the shifting the research agenda Provides a vision of how strong, basic and exciting education at university can be harmonized with life-long learning to obtain maximum value from the new powerful tools of analysis

Book Seventh Copper Mountain Conference on Multigrid Methods

Download or read book Seventh Copper Mountain Conference on Multigrid Methods written by N. Duane Melson and published by . This book was released on 1996 with total page 440 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Book New Results in Numerical and Experimental Fluid Mechanics X

Download or read book New Results in Numerical and Experimental Fluid Mechanics X written by Andreas Dillmann and published by Springer. This book was released on 2016-03-28 with total page 855 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book presents contributions to the 19th biannual symposium of the German Aerospace Aerodynamics Association (STAB) and the German Society for Aeronautics and Astronautics (DGLR). The individual chapters reflect ongoing research conducted by the STAB members in the field of numerical and experimental fluid mechanics and aerodynamics, mainly for (but not limited to) aerospace applications, and cover both nationally and EC-funded projects. Special emphasis is given to collaborative research projects conducted by German scientists and engineers from universities, research-establishments and industries. By addressing a number of cutting-edge applications, together with the relevant physical and mathematics fundamentals, the book provides readers with a comprehensive overview of the current research work in the field. Though the book’s primary emphasis is on the aerospace context, it also addresses further important applications, e.g. in ground transportation and energy.

Book Computational Modeling for Fluid Flow and Interfacial Transport

Download or read book Computational Modeling for Fluid Flow and Interfacial Transport written by Wei Shyy and published by Courier Corporation. This book was released on 2014-06-10 with total page 529 pages. Available in PDF, EPUB and Kindle. Book excerpt: Practical applications and examples highlight this treatment of computational modeling for handling complex flowfields. A reference for researchers and graduate students of many different backgrounds, it also functions as a text for learning essential computation elements. Drawing upon his own research, the author addresses both macroscopic and microscopic features. He begins his three-part treatment with a survey of the basic concepts of finite difference schemes for solving parabolic, elliptic, and hyperbolic partial differential equations. The second part concerns issues related to computational modeling for fluid flow and transport phenomena. In addition to a focus on pressure-based methods, this section also discusses practical engineering applications. The third and final part explores the transport processes involving interfacial dynamics, particularly those influenced by phase change, gravity, and capillarity. Case studies, employing previously discussed methods, demonstrate the interplay between the fluid and thermal transport at macroscopic scales and their interaction with the interfacial transport.

Book Finite Volume Method

    Book Details:
  • Author : Radostina Petrova
  • Publisher : BoD – Books on Demand
  • Release : 2012-03-28
  • ISBN : 9535104454
  • Pages : 388 pages

Download or read book Finite Volume Method written by Radostina Petrova and published by BoD – Books on Demand. This book was released on 2012-03-28 with total page 388 pages. Available in PDF, EPUB and Kindle. Book excerpt: We hope that among these chapters you will find a topic which will raise your interest and engage you to further investigate a problem and build on the presented work. This book could serve either as a textbook or as a practical guide. It includes a wide variety of concepts in FVM, result of the efforts of scientists from all over the world. However, just to help you, all book chapters are systemized in three general groups: New techniques and algorithms in FVM; Solution of particular problems through FVM and Application of FVM in medicine and engineering. This book is for everyone who wants to grow, to improve and to investigate.

Book Single Chain Polymer Nanoparticles

Download or read book Single Chain Polymer Nanoparticles written by José A. Pomposo and published by John Wiley & Sons. This book was released on 2017-08-18 with total page 504 pages. Available in PDF, EPUB and Kindle. Book excerpt: This first book on this important and emerging topic presents an overview of the very latest results obtained in single-chain polymer nanoparticles obtained by folding synthetic single polymer chains, painting a complete picture from synthesis via characterization to everyday applications. The initial chapters describe the synthetics methods as well as the molecular simulation of these nanoparticles, while subsequent chapters discuss the analytical techniques that are applied to characterize them, including size and structural characterization as well as scattering techniques. The final chapters are then devoted to the practical applications in nanomedicine, sensing, catalysis and several other uses, concluding with a look at the future for such nanoparticles. Essential reading for polymer and materials scientists, materials engineers, biochemists as well as environmental chemists.

Book MEMS Materials and Processes Handbook

Download or read book MEMS Materials and Processes Handbook written by Reza Ghodssi and published by Springer Science & Business Media. This book was released on 2011-03-18 with total page 1211 pages. Available in PDF, EPUB and Kindle. Book excerpt: MEMs Materials and Processes Handbook" is a comprehensive reference for researchers searching for new materials, properties of known materials, or specific processes available for MEMS fabrication. The content is separated into distinct sections on "Materials" and "Processes". The extensive Material Selection Guide" and a "Material Database" guides the reader through the selection of appropriate materials for the required task at hand. The "Processes" section of the book is organized as a catalog of various microfabrication processes, each with a brief introduction to the technology, as well as examples of common uses in MEMs.

Book Handbook of Industrial Water Soluble Polymers

Download or read book Handbook of Industrial Water Soluble Polymers written by Peter A. Williams and published by John Wiley & Sons. This book was released on 2008-04-15 with total page 344 pages. Available in PDF, EPUB and Kindle. Book excerpt: Natural and synthetic water soluble polymers are used in a wide range of familiar industrial and consumer products, including coatings and inks, papers, adhesives, cosmetics and personal care products. They perform a variety of functions without which these products would be significantly more expensive, less effective or both. Written for research, development and formulation chemists, technologists and engineers at graduate level and beyond in the fine and specialty chemicals, polymers, food and pharmaceutical industries, the Handbook of Industrial Water Soluble Polymers deals specifically with the functional properties of both natural and synthetic water soluble polymers. By taking a function based approach, rather than a “polymer specific” approach the book illustrates how polymer structure leads to effect, and shows how different polymer types can be employed to achieve appropriate product properties.

Book High Performance Polymers and Engineering Plastics

Download or read book High Performance Polymers and Engineering Plastics written by Vikas Mittal and published by John Wiley & Sons. This book was released on 2011-09-09 with total page 454 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book describes advances in synthesis, processing, and technology of environmentally friendly polymers generated from renewable resources. With contents based on a wide range of functional monomers and contributions from eminent researchers, this volume demonstrates the design, synthesis, properties and applications of plant oil based polymers, presenting an elaborate review of acid mediated polymerization techniques for the generation of green polymers. Chemical engineers are provided with state-of-the-art information that acts to further progress research in this direction.

Book Quieting the Boom

Download or read book Quieting the Boom written by Lawrence R. Benson and published by . This book was released on 2013 with total page 388 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Book Food Bioactives

Download or read book Food Bioactives written by Munish Puri and published by Springer. This book was released on 2017-04-07 with total page 329 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book focuses on various types of bioactive compounds, including secondary metabolites, oligosaccharides, polysaccharides, flavonoids, peptides/proteins, carotenoid pigments, quinones, terpenes, and polyunsaturated fatty acids, and presents an overview of their nutraceutical activities. It covers the current status and future potential of food compounds, as well as extraction technologies for bioactives derived from plant, fungi and marine-derived bioactive agents. Finally, health-promoting effects of plant, fungi and marine-derived bioactive agents are discussed. Chapters come from top researchers in this area from around the globe. The volume caters to the needs of undergraduate and post-graduate students in the area of food biotechnology, food bioprocessing, biotechnology, food engineering, etc., and also contains information pertinent to researchers.

Book Handbook of Benzoxazine Resins

Download or read book Handbook of Benzoxazine Resins written by Hatsuo Ishida and published by Elsevier. This book was released on 2011-07-13 with total page 709 pages. Available in PDF, EPUB and Kindle. Book excerpt: This handbook provides a wide overview of the field, fundamental understanding of the synthetic methods and structure/property correlation, as well as studies related to applications in a wide range of subjects. The handbook also provides 1H and 13C NMR spectra, FTIR spectra, DSC and TGA thermograms to aid in research activities. Additional tables on key NMR and FTIR frequencies unique to benzoxazine, heat of polymerization, Tg, and char yield will greatly aid in the choice of proper benzoxazine for a specific application. Provides thorough coverage of the chemistry and applications of benzoxazine resins with an evidence-based approach to enable chemists, engineers and material scientists to evaluate effectiveness Features spectra, which allow researchers to compare results, avoid repetition and save time as well as tables on key NMR frequency, IR frequency, heat of polymerization, of many benzoxazine resins to aid them in selection of materials Written by the foremost experts in the field

Book Biomechanics of the Brain

Download or read book Biomechanics of the Brain written by Karol Miller and published by Springer. This book was released on 2019-08-08 with total page 353 pages. Available in PDF, EPUB and Kindle. Book excerpt: This new edition presents an authoritative account of the current state of brain biomechanics research for engineers, scientists and medical professionals. Since the first edition in 2011, this topic has unquestionably entered into the mainstream of biomechanical research. The book brings together leading scientists in the diverse fields of anatomy, neuroimaging, image-guided neurosurgery, brain injury, solid and fluid mechanics, mathematical modelling and computer simulation to paint an inclusive picture of the rapidly evolving field. Covering topics from brain anatomy and imaging to sophisticated methods of modeling brain injury and neurosurgery (including the most recent applications of biomechanics to treat epilepsy), to the cutting edge methods in analyzing cerebrospinal fluid and blood flow, this book is the comprehensive reference in the field. Experienced researchers as well as students will find this book useful.