Download or read book Computational Methods for Macromolecules Challenges and Applications written by Tamar Schlick and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 504 pages. Available in PDF, EPUB and Kindle. Book excerpt: This special volume collects invited articles by participants of the Third International Workshop on Methods for Macromolecular Modeling, Courant Institute of Mathematical Sciences, Oct. 12-14, 2000. Leading developers of methods for biomolecular simulations review advances in Monte Carlo and molecular dynamics methods, free energy computational methods, fast electrostatics (particle-mesh Ewald and fast multipole methods), mathematics, and molecular neurobiology, nucleic acid simulations, enzyme reactions, and other essential applications in biomolecular simulations. A Perspectives article by the editors assesses the directions and impact of macromolecular modeling research, including genomics and proteomics. These reviews and original papers by applied mathematicians, theoretical chemists, biomedical researchers, and physicists are of interest to interdisciplinary research students, developers and users of biomolecular methods in academia and industry.

Download or read book Introduction to Numerical Methods for Variational Problems written by Hans Petter Langtangen and published by Springer Nature. This book was released on 2019-09-26 with total page 395 pages. Available in PDF, EPUB and Kindle. Book excerpt: This textbook teaches finite element methods from a computational point of view. It focuses on how to develop flexible computer programs with Python, a programming language in which a combination of symbolic and numerical tools is used to achieve an explicit and practical derivation of finite element algorithms. The finite element library FEniCS is used throughout the book, but the content is provided in sufficient detail to ensure that students with less mathematical background or mixed programming-language experience will equally benefit. All program examples are available on the Internet.

Download or read book Sparse Grids and Applications written by Jochen Garcke and published by Springer Science & Business Media. This book was released on 2012-10-13 with total page 290 pages. Available in PDF, EPUB and Kindle. Book excerpt: In the recent decade, there has been a growing interest in the numerical treatment of high-dimensional problems. It is well known that classical numerical discretization schemes fail in more than three or four dimensions due to the curse of dimensionality. The technique of sparse grids helps overcome this problem to some extent under suitable regularity assumptions. This discretization approach is obtained from a multi-scale basis by a tensor product construction and subsequent truncation of the resulting multiresolution series expansion. This volume of LNCSE is a collection of the papers from the proceedings of the workshop on sparse grids and its applications held in Bonn in May 2011. The selected articles present recent advances in the mathematical understanding and analysis of sparse grid discretization. Aspects arising from applications are given particular attention.

Download or read book Numerical Methods for General and Structured Eigenvalue Problems written by Daniel Kressner and published by Springer Science & Business Media. This book was released on 2006-01-20 with total page 272 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book is about computing eigenvalues, eigenvectors, and invariant subspaces of matrices. Treatment includes generalized and structured eigenvalue problems and all vital aspects of eigenvalue computations. A unique feature is the detailed treatment of structured eigenvalue problems, providing insight on accuracy and efficiency gains to be expected from algorithms that take the structure of a matrix into account.

Download or read book Numerical Methods for Flows written by Harald van Brummelen and published by Springer Nature. This book was released on 2020-02-22 with total page 358 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book includes selected contributions on applied mathematics, numerical analysis, numerical simulation and scientific computing related to fluid mechanics problems, presented at the FEF-“Finite Element for Flows” conference, held in Rome in spring 2017. Written by leading international experts and covering state-of-the-art topics in numerical simulation for flows, it provides fascinating insights into and perspectives on current and future methodological and numerical developments in computational science. As such, the book is a valuable resource for researchers, as well as Masters and Ph.D students.

Download or read book Computational Methods in Transport Verification and Validation written by Frank Graziani and published by Springer Science & Business Media. This book was released on 2008-08-09 with total page 336 pages. Available in PDF, EPUB and Kindle. Book excerpt: The focus of this book deals with a cross cutting issue affecting all transport disciplines, whether it be photon, neutron, charged particle or neutrino transport. That is, verification and validation. In this book, we learn what the astrophysicist, atmospheric scientist, mathematician or nuclear engineer do to assess the accuracy of their code. What convergence studies, what error analysis, what problems do each field use to ascertain the accuracy of their transport simulations.

Download or read book Sparse Grids and Applications Miami 2016 written by Jochen Garcke and published by Springer. This book was released on 2018-06-20 with total page 262 pages. Available in PDF, EPUB and Kindle. Book excerpt: Sparse grids are a popular tool for the numerical treatment of high-dimensional problems. Where classical numerical discretization schemes fail in more than three or four dimensions, sparse grids, in their different flavors, are frequently the method of choice. This volume of LNCSE presents selected papers from the proceedings of the fourth workshop on sparse grids and applications, and demonstrates once again the importance of this numerical discretization scheme. The articles present recent advances in the numerical analysis of sparse grids in connection with a range of applications including computational chemistry, computational fluid dynamics, and big data analytics, to name but a few.

Download or read book Numerical Mathematics and Advanced Applications ENUMATH 2019 written by Fred J. Vermolen and published by Springer Nature. This book was released on 2021-04-30 with total page 1185 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book gathers outstanding papers presented at the European Conference on Numerical Mathematics and Advanced Applications (ENUMATH 2019). The conference was organized by Delft University of Technology and was held in Egmond aan Zee, the Netherlands, from September 30 to October 4, 2019. Leading experts in the field presented the latest results and ideas regarding the design, implementation and analysis of numerical algorithms, as well as their applications to relevant societal problems. ENUMATH is a series of conferences held every two years to provide a forum for discussing basic aspects and new trends in numerical mathematics and scientific and industrial applications, all examined at the highest level of international expertise. The first ENUMATH was held in Paris in 1995, with successive installments at various sites across Europe, including Heidelberg (1997), Jyvaskyla (1999), lschia Porto (2001), Prague (2003), Santiago de Compostela (2005), Graz (2007), Uppsala (2009), Leicester (2011), Lausanne (2013), Ankara (2015) and Bergen (2017).

Download or read book Building Bridges Connections and Challenges in Modern Approaches to Numerical Partial Differential Equations written by Gabriel R. Barrenechea and published by Springer. This book was released on 2016-10-03 with total page 433 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume contains contributed survey papers from the main speakers at the LMS/EPSRC Symposium “Building bridges: connections and challenges in modern approaches to numerical partial differential equations”. This meeting took place in July 8-16, 2014, and its main purpose was to gather specialists in emerging areas of numerical PDEs, and explore the connections between the different approaches. The type of contributions ranges from the theoretical foundations of these new techniques, to the applications of them, to new general frameworks and unified approaches that can cover one, or more than one, of these emerging techniques.

Download or read book Numerical Geometry Grid Generation and Scientific Computing written by Vladimir A. Garanzha and published by Springer Nature. This book was released on 2019-10-10 with total page 320 pages. Available in PDF, EPUB and Kindle. Book excerpt: The focus of these conference proceedings is on research, development, and applications in the fields of numerical geometry, scientific computing and numerical simulation, particularly in mesh generation and related problems. In addition, this year’s special focus is on Voronoi diagrams and their applications, celebrating the 150th birthday of G.F. Voronoi. In terms of content, the book strikes a balance between engineering algorithms and mathematical foundations. It presents an overview of recent advances in numerical geometry, grid generation and adaptation in terms of mathematical foundations, algorithm and software development and applications. The specific topics covered include: quasi-conformal and quasi-isometric mappings, hyperelastic deformations, multidimensional generalisations of the equidistribution principle, discrete differential geometry, spatial and metric encodings, Voronoi-Delaunay theory for tilings and partitions, duality in mathematical programming and numerical geometry, mesh-based optimisation and optimal control methods. Further aspects examined include iterative solvers for variational problems and algorithm and software development. The applications of the methods discussed are multidisciplinary and include problems from mathematics, physics, biology, chemistry, material science, and engineering.

Download or read book High Order Nonlinear Numerical Schemes for Evolutionary PDEs written by Rémi Abgrall and published by Springer. This book was released on 2014-05-19 with total page 220 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book collects papers presented during the European Workshop on High Order Nonlinear Numerical Methods for Evolutionary PDEs (HONOM 2013) that was held at INRIA Bordeaux Sud-Ouest, Talence, France in March, 2013. The central topic is high order methods for compressible fluid dynamics. In the workshop, and in this proceedings, greater emphasis is placed on the numerical than the theoretical aspects of this scientific field. The range of topics is broad, extending through algorithm design, accuracy, large scale computing, complex geometries, discontinuous Galerkin, finite element methods, Lagrangian hydrodynamics, finite difference methods and applications and uncertainty quantification. These techniques find practical applications in such fields as fluid mechanics, magnetohydrodynamics, nonlinear solid mechanics, and others for which genuinely nonlinear methods are needed.

Download or read book Elements of Scientific Computing written by Aslak Tveito and published by Springer Science & Business Media. This book was released on 2010-09-27 with total page 470 pages. Available in PDF, EPUB and Kindle. Book excerpt: Science used to be experiments and theory, now it is experiments, theory and computations. The computational approach to understanding nature and technology is currently flowering in many fields such as physics, geophysics, astrophysics, chemistry, biology, and most engineering disciplines. This book is a gentle introduction to such computational methods where the techniques are explained through examples. It is our goal to teach principles and ideas that carry over from field to field. You will learn basic methods and how to implement them. In order to gain the most from this text, you will need prior knowledge of calculus, basic linear algebra and elementary programming.

Download or read book Scientific Computing with MATLAB and Octave written by Alfio Quarteroni and published by Springer Science & Business Media. This book was released on 2010-05-30 with total page 379 pages. Available in PDF, EPUB and Kindle. Book excerpt: Preface to the First Edition This textbook is an introduction to Scienti?c Computing. We will illustrate several numerical methods for the computer solution of c- tain classes of mathematical problems that cannot be faced by paper and pencil. We will show how to compute the zeros or the integrals of continuous functions, solve linear systems, approximate functions by polynomials and construct accurate approximations for the solution of di?erential equations. With this aim, in Chapter 1 we will illustrate the rules of the game thatcomputersadoptwhenstoringandoperatingwith realandcomplex numbers, vectors and matrices. In order to make our presentation concrete and appealing we will 1 adopt the programming environment MATLAB as a faithful c- panion. We will gradually discover its principal commands, statements and constructs. We will show how to execute all the algorithms that we introduce throughout the book. This will enable us to furnish an - mediate quantitative assessment of their theoretical properties such as stability, accuracy and complexity. We will solve several problems that will be raisedthrough exercises and examples, often stemming from s- ci?c applications.

Download or read book Meshfree Methods for Partial Differential Equations IV written by Michael Griebel and published by Springer Science & Business Media. This book was released on 2008-10-16 with total page 404 pages. Available in PDF, EPUB and Kindle. Book excerpt: The numerical treatment of partial differential equations with particle methods and meshfree discretization techniques is a active research field both in the mathematics and engineering community. This volume of LNCSE is a collection of the proceedings papers of the Fourth International Workshop on Meshfree Methods held in September 2007 in Bonn.

Download or read book Meshfree Methods for Partial Differential Equations V written by Michael Griebel and published by Springer Science & Business Media. This book was released on 2010-11-04 with total page 271 pages. Available in PDF, EPUB and Kindle. Book excerpt: The numerical treatment of partial differential equations with particle methods and meshfree discretization techniques is an extremely active research field, both in the mathematics and engineering communities. Meshfree methods are becoming increasingly mainstream in various applications. Due to their independence of a mesh, particle schemes and meshfree methods can deal with large geometric changes of the domain more easily than classical discretization techniques. Furthermore, meshfree methods offer a promising approach for the coupling of particle models to continuous models. This volume of LNCSE is a collection of the papers from the proceedings of the Fifth International Workshop on Meshfree Methods, held in Bonn in August 2009. The articles address the different meshfree methods and their use in applied mathematics, physics and engineering. The volume is intended to foster this highly active and exciting area of interdisciplinary research and to present recent advances and findings in this field.

Download or read book Numerical Analysis of Multiscale Computations written by Björn Engquist and published by Springer Science & Business Media. This book was released on 2011-10-14 with total page 432 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book is a snapshot of current research in multiscale modeling, computations and applications. It covers fundamental mathematical theory, numerical algorithms as well as practical computational advice for analysing single and multiphysics models containing a variety of scales in time and space. Complex fluids, porous media flow and oscillatory dynamical systems are treated in some extra depth, as well as tools like analytical and numerical homogenization, and fast multipole method.

Download or read book Numerical Mathematics and Advanced Applications ENUMATH 2013 written by Assyr Abdulle and published by Springer. This book was released on 2014-11-25 with total page 810 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book gathers a selection of invited and contributed lectures from the European Conference on Numerical Mathematics and Advanced Applications (ENUMATH) held in Lausanne, Switzerland, August 26-30, 2013. It provides an overview of recent developments in numerical analysis, computational mathematics and applications from leading experts in the field. New results on finite element methods, multiscale methods, numerical linear algebra and discretization techniques for fluid mechanics and optics are presented. As such, the book offers a valuable resource for a wide range of readers looking for a state-of-the-art overview of advanced techniques, algorithms and results in numerical mathematics and scientific computing.