Physics-Based and Data-Driven Mulitiscale Modeling of the Structural Formation in Macromolecular Systems (Band 25)

Download Physics-Based and Data-Driven Mulitiscale Modeling of the Structural Formation in Macromolecular Systems (Band 25) PDF Online Free

Author :
Publisher : Cuvillier Verlag
ISBN 13 : 3736969724
Total Pages : 297 pages
Book Rating : 4.7/5 (369 download)

DOWNLOAD NOW!


Book Synopsis Physics-Based and Data-Driven Mulitiscale Modeling of the Structural Formation in Macromolecular Systems (Band 25) by : Philipp Nicolas Depta

Download or read book Physics-Based and Data-Driven Mulitiscale Modeling of the Structural Formation in Macromolecular Systems (Band 25) written by Philipp Nicolas Depta and published by Cuvillier Verlag. This book was released on 2024-02-27 with total page 297 pages. Available in PDF, EPUB and Kindle. Book excerpt: In order to improve knowledge on macromolecular structural formation and self-assembly, this work proposes a physics-based and data-driven multiscale modeling framework capable of describing structural formation on micro-meter and milli-second scales near molecular-level precision. The framework abstracts macromolecules as anisotropic unit objects and models the interactions and environment using data-driven approaches. The models are parameterized in a bottom-up fashion and validated top-down by comparison with literature and collaborator data for self-assembly of three model system: alginate gelation, hepatitis B virus capsids, and the pyruvate dehydrogenase complex.

Physics-Based and Data-Driven Mulitiscale Modeling of the Structural Formation in Macromolecular Systems

Download Physics-Based and Data-Driven Mulitiscale Modeling of the Structural Formation in Macromolecular Systems PDF Online Free

Author :
Publisher :
ISBN 13 : 9783736979727
Total Pages : 0 pages
Book Rating : 4.9/5 (797 download)

DOWNLOAD NOW!


Book Synopsis Physics-Based and Data-Driven Mulitiscale Modeling of the Structural Formation in Macromolecular Systems by : Philipp Nicolas Depta

Download or read book Physics-Based and Data-Driven Mulitiscale Modeling of the Structural Formation in Macromolecular Systems written by Philipp Nicolas Depta and published by . This book was released on 2024 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Principles of Multiscale Modeling

Download Principles of Multiscale Modeling PDF Online Free

Author :
Publisher : Cambridge University Press
ISBN 13 : 1107096545
Total Pages : 485 pages
Book Rating : 4.1/5 (7 download)

DOWNLOAD NOW!


Book Synopsis Principles of Multiscale Modeling by : Weinan E

Download or read book Principles of Multiscale Modeling written by Weinan E and published by Cambridge University Press. This book was released on 2011-07-07 with total page 485 pages. Available in PDF, EPUB and Kindle. Book excerpt: A systematic discussion of the fundamental principles, written by a leading contributor to the field.

Practical Aspects of Computational Chemistry

Download Practical Aspects of Computational Chemistry PDF Online Free

Author :
Publisher : Springer Science & Business Media
ISBN 13 : 9048126878
Total Pages : 468 pages
Book Rating : 4.0/5 (481 download)

DOWNLOAD NOW!


Book Synopsis Practical Aspects of Computational Chemistry by : Jerzy Leszczynski

Download or read book Practical Aspects of Computational Chemistry written by Jerzy Leszczynski and published by Springer Science & Business Media. This book was released on 2009-10-03 with total page 468 pages. Available in PDF, EPUB and Kindle. Book excerpt: "Practical Aspects of Computational Chemistry" presents contributions on a range of aspects of Computational Chemistry applied to a variety of research fields. The chapters focus on recent theoretical developments which have been used to investigate structures and properties of large systems with minimal computational resources. Studies include those in the gas phase, various solvents, various aspects of computational multiscale modeling, Monte Carlo simulations, chirality, the multiple minima problem for protein folding, the nature of binding in different species and dihydrogen bonds, carbon nanotubes and hydrogen storage, adsorption and decomposition of organophosphorus compounds, X-ray crystallography, proton transfer, structure-activity relationships, a description of the REACH programs of the European Union for chemical regulatory purposes, reactions of nucleic acid bases with endogenous and exogenous reactive oxygen species and different aspects of nucleic acid bases, base pairs and base tetrads.

Multiscale Modeling and Simulation of Composite Materials and Structures

Download Multiscale Modeling and Simulation of Composite Materials and Structures PDF Online Free

Author :
Publisher : Springer Science & Business Media
ISBN 13 : 0387363181
Total Pages : 634 pages
Book Rating : 4.3/5 (873 download)

DOWNLOAD NOW!


Book Synopsis Multiscale Modeling and Simulation of Composite Materials and Structures by : Young Kwon

Download or read book Multiscale Modeling and Simulation of Composite Materials and Structures written by Young Kwon and published by Springer Science & Business Media. This book was released on 2007-12-04 with total page 634 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book presents the state-of-the-art in multiscale modeling and simulation techniques for composite materials and structures. It focuses on the structural and functional properties of engineering composites and the sustainable high performance of components and structures. The multiscale techniques can be also applied to nanocomposites which are important application areas in nanotechnology. There are few books available on this topic.

The Deep Learning Revolution

Download The Deep Learning Revolution PDF Online Free

Author :
Publisher : MIT Press
ISBN 13 : 026203803X
Total Pages : 354 pages
Book Rating : 4.2/5 (62 download)

DOWNLOAD NOW!


Book Synopsis The Deep Learning Revolution by : Terrence J. Sejnowski

Download or read book The Deep Learning Revolution written by Terrence J. Sejnowski and published by MIT Press. This book was released on 2018-10-23 with total page 354 pages. Available in PDF, EPUB and Kindle. Book excerpt: How deep learning—from Google Translate to driverless cars to personal cognitive assistants—is changing our lives and transforming every sector of the economy. The deep learning revolution has brought us driverless cars, the greatly improved Google Translate, fluent conversations with Siri and Alexa, and enormous profits from automated trading on the New York Stock Exchange. Deep learning networks can play poker better than professional poker players and defeat a world champion at Go. In this book, Terry Sejnowski explains how deep learning went from being an arcane academic field to a disruptive technology in the information economy. Sejnowski played an important role in the founding of deep learning, as one of a small group of researchers in the 1980s who challenged the prevailing logic-and-symbol based version of AI. The new version of AI Sejnowski and others developed, which became deep learning, is fueled instead by data. Deep networks learn from data in the same way that babies experience the world, starting with fresh eyes and gradually acquiring the skills needed to navigate novel environments. Learning algorithms extract information from raw data; information can be used to create knowledge; knowledge underlies understanding; understanding leads to wisdom. Someday a driverless car will know the road better than you do and drive with more skill; a deep learning network will diagnose your illness; a personal cognitive assistant will augment your puny human brain. It took nature many millions of years to evolve human intelligence; AI is on a trajectory measured in decades. Sejnowski prepares us for a deep learning future.

Design and Modeling for Computer Experiments

Download Design and Modeling for Computer Experiments PDF Online Free

Author :
Publisher : CRC Press
ISBN 13 : 1420034898
Total Pages : 304 pages
Book Rating : 4.4/5 (2 download)

DOWNLOAD NOW!


Book Synopsis Design and Modeling for Computer Experiments by : Kai-Tai Fang

Download or read book Design and Modeling for Computer Experiments written by Kai-Tai Fang and published by CRC Press. This book was released on 2005-10-14 with total page 304 pages. Available in PDF, EPUB and Kindle. Book excerpt: Computer simulations based on mathematical models have become ubiquitous across the engineering disciplines and throughout the physical sciences. Successful use of a simulation model, however, requires careful interrogation of the model through systematic computer experiments. While specific theoretical/mathematical examinations of computer experim

Modeling Materials

Download Modeling Materials PDF Online Free

Author :
Publisher : Cambridge University Press
ISBN 13 : 1139500651
Total Pages : 789 pages
Book Rating : 4.1/5 (395 download)

DOWNLOAD NOW!


Book Synopsis Modeling Materials by : Ellad B. Tadmor

Download or read book Modeling Materials written by Ellad B. Tadmor and published by Cambridge University Press. This book was released on 2011-11-24 with total page 789 pages. Available in PDF, EPUB and Kindle. Book excerpt: Material properties emerge from phenomena on scales ranging from Angstroms to millimeters, and only a multiscale treatment can provide a complete understanding. Materials researchers must therefore understand fundamental concepts and techniques from different fields, and these are presented in a comprehensive and integrated fashion for the first time in this book. Incorporating continuum mechanics, quantum mechanics, statistical mechanics, atomistic simulations and multiscale techniques, the book explains many of the key theoretical ideas behind multiscale modeling. Classical topics are blended with new techniques to demonstrate the connections between different fields and highlight current research trends. Example applications drawn from modern research on the thermo-mechanical properties of crystalline solids are used as a unifying focus throughout the text. Together with its companion book, Continuum Mechanics and Thermodynamics (Cambridge University Press, 2011), this work presents the complete fundamentals of materials modeling for graduate students and researchers in physics, materials science, chemistry and engineering.

Ionic Liquids

Download Ionic Liquids PDF Online Free

Author :
Publisher : Elsevier
ISBN 13 : 0080959075
Total Pages : 521 pages
Book Rating : 4.0/5 (89 download)

DOWNLOAD NOW!


Book Synopsis Ionic Liquids by : Suojiang Zhang

Download or read book Ionic Liquids written by Suojiang Zhang and published by Elsevier. This book was released on 2009-06-13 with total page 521 pages. Available in PDF, EPUB and Kindle. Book excerpt: This comprehensive database on physical properties of pure ionic liquids (ILs) contains data collected from 269 peer-reviewed papers in the period from 1982 to June 2008. There are more than 9,400 data points on the 29 kinds of physicochemical properties for 1886 available ionic liquids, from which 807 kinds of cations and 185 kinds of anions were extracted. This book includes nearly all known pure ILs and their known physicochemical properties through June 2008. In addition, the authors incorporate the main applications of individual ILs and a large number of references. - Nearly 50 tables include typical data, experimental and modelling or simulation comparison, and model parameters, enhancing the application of ILs - 100 figures--from QSPR, EOS and gE models to quantum and molecular simulations--help readers understand ILs at molecular level - Applications illustrate the role of IL properties in industry, in particular the development of novel clean processes and products

Atomistic Simulation of Anistropic Crystal Structures at Nanoscale

Download Atomistic Simulation of Anistropic Crystal Structures at Nanoscale PDF Online Free

Author :
Publisher : BoD – Books on Demand
ISBN 13 : 1838802010
Total Pages : 180 pages
Book Rating : 4.8/5 (388 download)

DOWNLOAD NOW!


Book Synopsis Atomistic Simulation of Anistropic Crystal Structures at Nanoscale by : Jia Fu

Download or read book Atomistic Simulation of Anistropic Crystal Structures at Nanoscale written by Jia Fu and published by BoD – Books on Demand. This book was released on 2019-05-10 with total page 180 pages. Available in PDF, EPUB and Kindle. Book excerpt: Multiscale simulations of atomistic/continuum coupling in computational materials science, where the scale expands from macro-/micro- to nanoscale, has become a hot research topic. These small units, usually nanostructures, are commonly anisotropic. The development of molecular modeling tools to describe and predict the mechanical properties of structures reveals an undeniable practical importance. Typical anisotropic structures (e.g. cubic, hexagonal, monoclinic) using DFT, MD, and atomic finite element methods are especially interesting, according to the modeling requirement of upscaling structures. It therefore connects nanoscale modeling and continuous patterns of deformation behavior by identifying relevant parameters from smaller to larger scales. These methodologies have the prospect of significant applications. I would like to recommend this book to both beginners and experienced researchers.

Springer Handbook of Electrochemical Energy

Download Springer Handbook of Electrochemical Energy PDF Online Free

Author :
Publisher : Springer
ISBN 13 : 3662466570
Total Pages : 1019 pages
Book Rating : 4.6/5 (624 download)

DOWNLOAD NOW!


Book Synopsis Springer Handbook of Electrochemical Energy by : Cornelia Breitkopf

Download or read book Springer Handbook of Electrochemical Energy written by Cornelia Breitkopf and published by Springer. This book was released on 2016-12-05 with total page 1019 pages. Available in PDF, EPUB and Kindle. Book excerpt: This comprehensive handbook covers all fundamentals of electrochemistry for contemporary applications. It provides a rich presentation of related topics of electrochemistry with a clear focus on energy technologies. It covers all aspects of electrochemistry starting with theoretical concepts and basic laws of thermodynamics, non-equilibrium thermodynamics and multiscale modeling. It further gathers the basic experimental methods such as potentiometry, reference electrodes, ion-sensitive electrodes, voltammetry and amperometry. The contents cover subjects related to mass transport, the electric double layer, ohmic losses and experimentation affecting electrochemical reactions. These aspects of electrochemistry are especially examined in view of specific energy technologies including batteries, polymer electrolyte and biological fuel cells, electrochemical capacitors, electrochemical hydrogen production and photoelectrochemistry. Organized in six parts, the overall complexity of electrochemistry is presented and makes this handbook an authoritative reference and definitive source for advanced students, professionals and scientists particularly interested in industrial and energy applications.

Multiscale Problems: Theory, Numerical Approximation And Applications

Download Multiscale Problems: Theory, Numerical Approximation And Applications PDF Online Free

Author :
Publisher : World Scientific
ISBN 13 : 9814458120
Total Pages : 314 pages
Book Rating : 4.8/5 (144 download)

DOWNLOAD NOW!


Book Synopsis Multiscale Problems: Theory, Numerical Approximation And Applications by : Alain Damlamian

Download or read book Multiscale Problems: Theory, Numerical Approximation And Applications written by Alain Damlamian and published by World Scientific. This book was released on 2011-10-13 with total page 314 pages. Available in PDF, EPUB and Kindle. Book excerpt: The focus of this is on the latest developments related to the analysis of problems in which several scales are presented. After a theoretical presentation of the theory of homogenization in the periodic case, the other contributions address a wide range of applications in the fields of elasticity (asymptotic behavior of nonlinear elastic thin structures, modeling of junction of a periodic family of rods with a plate) and fluid mechanics (stationary Navier-Stokes equations in porous media). Other applications concern the modeling of new composites (electromagnetic and piezoelectric materials) and imperfect transmission problems. A detailed approach of numerical finite element methods is also investigated.

Protein Self-Assembly

Download Protein Self-Assembly PDF Online Free

Author :
Publisher : Humana
ISBN 13 : 9781493996803
Total Pages : 266 pages
Book Rating : 4.9/5 (968 download)

DOWNLOAD NOW!


Book Synopsis Protein Self-Assembly by : Jennifer J. McManus

Download or read book Protein Self-Assembly written by Jennifer J. McManus and published by Humana. This book was released on 2020-08-08 with total page 266 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume explores experimental and computational approaches to measuring the most widely studied protein assemblies, including condensed liquid phases, aggregates, and crystals. The chapters in this book are organized into three parts: Part One looks at the techniques used to measure protein-protein interactions and equilibrium protein phases in dilute and concentrated protein solutions; Part Two describes methods to measure kinetics of aggregation and to characterize the assembled state; and Part Three details several different computational approaches that are currently used to help researchers understand protein self-assembly. Written in the highly successful Methods in Molecular Biology series format, chapters include introductions to their respective topics, lists of the necessary materials and reagents, step-by-step, readily reproducible laboratory protocols, and tips on troubleshooting and avoiding known pitfalls. Thorough and cutting-edge, Protein Self-Assembly: Methods and Protocols is a valuable resource for researchers who are interested in learning more about this developing field.

From Multiscale Modeling to Meso-Science

Download From Multiscale Modeling to Meso-Science PDF Online Free

Author :
Publisher : Springer Science & Business Media
ISBN 13 : 3642351891
Total Pages : 497 pages
Book Rating : 4.6/5 (423 download)

DOWNLOAD NOW!


Book Synopsis From Multiscale Modeling to Meso-Science by : Jinghai Li

Download or read book From Multiscale Modeling to Meso-Science written by Jinghai Li and published by Springer Science & Business Media. This book was released on 2013-03-22 with total page 497 pages. Available in PDF, EPUB and Kindle. Book excerpt: Multiscale modeling is becoming essential for accurate, rapid simulation in science and engineering. This book presents the results of three decades of research on multiscale modeling in process engineering from principles to application, and its generalization for different fields. This book considers the universality of meso-scale phenomena for the first time, and provides insight into the emerging discipline that unifies them, meso-science, as well as new perspectives for virtual process engineering. Multiscale modeling is applied in areas including: multiphase flow and fluid dynamics chemical, biochemical and process engineering mineral processing and metallurgical engineering energy and resources materials science and engineering Jinghai Li is Vice-President of the Chinese Academy of Sciences (CAS), a professor at the Institute of Process Engineering, CAS, and leader of the EMMS (Energy-minimizing multiscale) Group. Wei Ge, Wei Wang, Ning Yang and Junwu Wang are professors at the EMMS Group, part of the Institute of Process Engineering, CAS. Xinhua Liu, Limin Wang, Xianfeng He and Xiaowei Wang are associate professors at the EMMS Group, part of the Institute of Process Engineering, CAS. Mooson Kwauk is an emeritus director of the Institute of Process Engineering, CAS, and is an advisor to the EMMS Group.

Simulation Methods for Polymers

Download Simulation Methods for Polymers PDF Online Free

Author :
Publisher : CRC Press
ISBN 13 : 0824751310
Total Pages : 572 pages
Book Rating : 4.8/5 (247 download)

DOWNLOAD NOW!


Book Synopsis Simulation Methods for Polymers by : Michael Kotelyanskii

Download or read book Simulation Methods for Polymers written by Michael Kotelyanskii and published by CRC Press. This book was released on 2004-03-01 with total page 572 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Polyurethane Elastomers

Download Polyurethane Elastomers PDF Online Free

Author :
Publisher : Springer Science & Business Media
ISBN 13 : 3709105145
Total Pages : 276 pages
Book Rating : 4.7/5 (91 download)

DOWNLOAD NOW!


Book Synopsis Polyurethane Elastomers by : Cristina Prisacariu

Download or read book Polyurethane Elastomers written by Cristina Prisacariu and published by Springer Science & Business Media. This book was released on 2011-07-03 with total page 276 pages. Available in PDF, EPUB and Kindle. Book excerpt: A comprehensive account of the physical / mechanical behaviour of polyurethanes (PU ́s) elastomers, films and blends of variable crystallinity. Aspects covered include the elasticity and inelasticity of amorphous to crystalline PUs, in relation to their sensitivity to chemical and physical structure. A study is made of how aspects of the constitutive responses of PUs vary with composition: the polyaddition procedure, the hard segment, soft segment and chain extender (diols and diamines) are varied systematically in a large number of systems of model and novel crosslinked andthermoplastic PUs. Results will be related to: microstructural changes, on the basis of evidence from x-ray scattering (SAXS and WAXS), and also dynamic mechanical analyses (DMA), differential scanning calorimetry (DSC) and IR dichroism. Inelastic effects will be investigated also by including quantitative correlations between the magnitude of the Mullins effect and the fractional energy dissipation by hysteresis under cyclic straining, giving common relations approached by all the materials studied. A major structural feature explored is the relationship between the nature of the hard segment (crystallising or not) and that of the soft segments. Crystallinity has been sometimes observed in the commercial PUs hard phase but this is usually limited to only a few percent for most hard segment structures when solidified from the melt. One particular diisocyanate, 4,4’-dibenzyl diisocyanate (DBDI) that, in the presence of suitable chain extenders ( diols or diamines), gives rise to significant degrees of crystallinity [i-iii] and this is included in the present work. Understanding the reaction pathways involved, in resolving the subtle morphological evolution at the nanometre level, and capturing mathematically the complex, large-deformation nonlinear viscoelastic mechanical behaviour are assumed to bring new important insights in the world basic research in polyurethanes and towards applied industrial research in this area.

Biomateriomics

Download Biomateriomics PDF Online Free

Author :
Publisher : Springer Science & Business Media
ISBN 13 : 9400716109
Total Pages : 446 pages
Book Rating : 4.4/5 (7 download)

DOWNLOAD NOW!


Book Synopsis Biomateriomics by : Steven W. Cranford

Download or read book Biomateriomics written by Steven W. Cranford and published by Springer Science & Business Media. This book was released on 2012-05-23 with total page 446 pages. Available in PDF, EPUB and Kindle. Book excerpt: Biomateriomics is the holistic study of biological material systems. While such systems are undoubtedly complex, we frequently encounter similar components -- universal building blocks and hierarchical structure motifs -- which result in a diverse set of functionalities. Similar to the way music or language arises from a limited set of music notes and words, we exploit the relationships between form and function in a meaningful way by recognizing the similarities between Beethoven and bone, or Shakespeare and silk. Through the investigation of material properties, examining fundamental links between processes, structures, and properties at multiple scales and their interactions, materiomics explains system functionality from the level of building blocks. Biomateriomics specifically focuses the analysis of the role of materials in the context of biological processes, the transfer of biological material principles towards biomimetic and bioinspired applications, and the study of interfaces between living and non-living systems. The challenges of biological materials are vast, but the convergence of biology, mathematics and engineering as well as computational and experimental techniques have resulted in the toolset necessary to describe complex material systems, from nano to macro. Applying biomateriomics can unlock Nature’s secret to high performance materials such as spider silk, bone, and nacre, and elucidate the progression and diagnosis or the treatment of diseases. Similarly, it contributes to develop a de novo understanding of biological material processes and to the potential of exploiting novel concepts in innovation, material synthesis and design.