Computational Studies
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Computational Studies
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Author : Ambrish Kumar Srivastava
language : en
Publisher: CRC Press
Release Date : 2024-08-06
Computational Studies written by Ambrish Kumar Srivastava and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2024-08-06 with Science categories.
The book covers a diverse range of topics based on computational studies, including modeling and simulations based on quantum chemical studies and molecular dynamics (MD) simulations. It contains quantum chemical studies on several molecules, including biologically relevant molecules and liquid crystals and various aspects of superatomic clusters including superalkalis and superhalogens. It gives an overview of MD simulations and their applications on biomolecular systems such as HIV-1 protease and integrase. Features: Includes first principle methods, density functional theory, as well as molecular dynamics simulations. Explores quantum chemical studies on several molecules. Gives readers an overview of the power of computation. Discusses superatomic clusters, superalkalis, and superhalogens. Covers themes from molecules, clusters, materials, as well as biophysical systems. This book is aimed at researchers and graduate students in materials science and computational and theoretical chemistry.
Computational Conflict Research
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Author : Emanuel Deutschmann
language : en
Publisher: Springer Nature
Release Date : 2019-11-09
Computational Conflict Research written by Emanuel Deutschmann and has been published by Springer Nature this book supported file pdf, txt, epub, kindle and other format this book has been release on 2019-11-09 with Social Science categories.
This open access book brings together a set of original studies that use cutting-edge computational methods to investigate conflict at various geographic scales and degrees of intensity and violence. Methodologically, this book covers a variety of computational approaches from text mining and machine learning to agent-based modelling and social network analysis. Empirical cases range from migration policy framing in North America and street protests in Iran to violence against civilians in Congo and food riots world-wide. Supplementary materials in the book include a comprehensive list of the datasets on conflict and dissent, as well as resources to online repositories where the annotated code and data of individual chapters can be found and where (agent-based) models can be re-produced and altered. These materials are a valuable resource for those wishing to retrace and learn from the analyses described in this volume and adapt and apply them to their own research interests. By bringing together novel research through an international team of scholars from a range of disciplines, Computational Conflict Research pioneers and maps this emerging field. The book will appeal to students, scholars, and anyone interested in the prospects of using computational social sciences to advance our understanding of conflict dynamics.
Computational Studies In Organometallic Chemistry
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Author : Stuart A. Macgregor
language : en
Publisher: Springer
Release Date : 2016-05-14
Computational Studies In Organometallic Chemistry written by Stuart A. Macgregor and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2016-05-14 with Science categories.
The series Structure and Bonding publishes critical Reviews on Topics of Research concerned with chemical structure and bonding. The scope of the series spans the entire Periodic Table and addresses structure and bonding issues associated with all of the elements. It also focuses attention on new and developing areas of modern structural and theoretical chemistry such as nanostructures, molecular electronics, designed molecular solids, surfaces, metal clusters and supramolecular structures. Physical and spectroscopic techniques used to determine, examine and model structures fall within the purview of Structure and Bonding to the extent that the focus is on the scientific results obtained and not on specialist information concerning the techniques themselves. Issues associated with the development of bonding models and generalizations that illuminate the reactivity pathways and rates of chemical processes are also relevant. The individual volumes in the series are thematic. The goal of each volume is to give the reader, whether at a university or in industry, a comprehensive overview of an area where new insights are emerging that are of interest to a larger scientific audience. Thus each review within the volume critically surveys one aspect of that topic and places it within the context of the volume as a whole. The most significant developments of the last 5 to 10 years should be presented using selected examples to illustrate the principles discussed. A description of the physical basis of the experimental techniques that have been used to provide the primary data may also be appropriate, if it has not been covered in detail elsewhere. The coverage need not be exhaustive in data, but should rather be conceptual, concentrating on the new principles being developed that will allow the reader, who is not a specialist in the area covered, to understand the data presented. Discussion of possible future research directions in the area is welcomed.
Computational Legal Studies
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Author : Ryan Whalen
language : en
Publisher: Edward Elgar Publishing
Release Date : 2020-09-25
Computational Legal Studies written by Ryan Whalen and has been published by Edward Elgar Publishing this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020-09-25 with Law categories.
Featuring contributions from a diverse set of experts, this thought-provoking book offers a visionary introduction to the computational turn in law and the resulting emergence of the computational legal studies field. It explores how computational data creation, collection, and analysis techniques are transforming the way in which we comprehend and study the law, and the implications that this has for the future of legal studies.
Handbook Of Computational Social Science Volume 1
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Author : Uwe Engel
language : en
Publisher: Taylor & Francis
Release Date : 2021-11-10
Handbook Of Computational Social Science Volume 1 written by Uwe Engel and has been published by Taylor & Francis this book supported file pdf, txt, epub, kindle and other format this book has been release on 2021-11-10 with Computers categories.
The Handbook of Computational Social Science is a comprehensive reference source for scholars across multiple disciplines. It outlines key debates in the field, showcasing novel statistical modeling and machine learning methods, and draws from specific case studies to demonstrate the opportunities and challenges in CSS approaches. The Handbook is divided into two volumes written by outstanding, internationally renowned scholars in the field. This first volume focuses on the scope of computational social science, ethics, and case studies. It covers a range of key issues, including open science, formal modeling, and the social and behavioral sciences. This volume explores major debates, introduces digital trace data, reviews the changing survey landscape, and presents novel examples of computational social science research on sensing social interaction, social robots, bots, sentiment, manipulation, and extremism in social media. The volume not only makes major contributions to the consolidation of this growing research field but also encourages growth in new directions. With its broad coverage of perspectives (theoretical, methodological, computational), international scope, and interdisciplinary approach, this important resource is integral reading for advanced undergraduates, postgraduates, and researchers engaging with computational methods across the social sciences, as well as those within the scientifi c and engineering sectors.
Numerical Methods For Roots Of Polynomials Part Ii
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Author : J.M. McNamee
language : en
Publisher: Newnes
Release Date : 2013-07-19
Numerical Methods For Roots Of Polynomials Part Ii written by J.M. McNamee and has been published by Newnes this book supported file pdf, txt, epub, kindle and other format this book has been release on 2013-07-19 with Mathematics categories.
Numerical Methods for Roots of Polynomials - Part II along with Part I (9780444527295) covers most of the traditional methods for polynomial root-finding such as interpolation and methods due to Graeffe, Laguerre, and Jenkins and Traub. It includes many other methods and topics as well and has a chapter devoted to certain modern virtually optimal methods. Additionally, there are pointers to robust and efficient programs. This book is invaluable to anyone doing research in polynomial roots, or teaching a graduate course on that topic. - First comprehensive treatment of Root-Finding in several decades with a description of high-grade software and where it can be downloaded - Offers a long chapter on matrix methods and includes Parallel methods and errors where appropriate - Proves invaluable for research or graduate course
Computational Studies Of Rna And Dna
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Author : Jirí Šponer
language : en
Publisher: Springer
Release Date : 2010-11-25
Computational Studies Of Rna And Dna written by Jirí Šponer and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2010-11-25 with Science categories.
This book integrates modern computational studies of nucleic acids, ranging from advanced electronic structure quantum chemical calculations through explicit solvent molecular dynamics (MD) simulations up to mesoscopic modelling, with the main focus given to the MD field. It gives an equal emphasis to the leading methods and applications while successes as well as pitfalls of the computational techniques are discussed.
Computational Research In Ethnic And Migration Studies
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Author : Emanuel Deutschmann
language : en
Publisher: Taylor & Francis
Release Date : 2024-11-08
Computational Research In Ethnic And Migration Studies written by Emanuel Deutschmann and has been published by Taylor & Francis this book supported file pdf, txt, epub, kindle and other format this book has been release on 2024-11-08 with Social Science categories.
This book showcases the potential of computational approaches for research questions at the heart of migration and integration research via a set of original, cutting-edge empirical studies by a diverse, international team of authors. Why do people emigrate? Do weather conditions and climate change affect decisions to migrate? How do migration networks evolve on a global scale? Can we predict refugee movements? How do host communities respond to the influx of refugees? Do right-wing populist parties get stronger where lots of refugees are located? Do terror attacks lead to more hostility towards immigrants? What mechanisms explain neighborhood ethnic segregation? The collection of studies in this book harnesses the power of an emerging interdisciplinary research field known as computational social science to shed new light on such classic questions of migration and integration research. The cutting-edge empirical studies use a wide range of computational approaches, from agent-based modeling and network analysis to machine learning, natural language processing, and advanced spatial methods and cover detailed spatial, textual, and network data from both online and offline sources. The book thus demonstrates the potential of computational approaches for migration and integration research, while also discussing the challenges that arise in this emerging field. This book will be an invaluable resource for researchers, students of sociology, ethnic and migration studies, international politics, and computational social science. It was originally published as a special issue of the Journal of Ethnic and Migration Studies.
Biomembrane Simulations
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Author : Max L. Berkowitz
language : en
Publisher: CRC Press
Release Date : 2019-04-30
Biomembrane Simulations written by Max L. Berkowitz and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2019-04-30 with Science categories.
Due to recent advancements in the development of numerical algorithms and computational hardware, computer simulations of biological membranes, often requiring use of substantial computational resources, are now reaching a mature stage. Since molecular processes in membranes occur on a multitude of spatial and time scales, molecular simulations of membranes can also serve as a testing ground for use of multi-scale simulation techniques. This book addresses some of the important issues related to understanding properties and behavior of model biological membranes and it Shows how simulations improve our understanding of biological membranes and makes connections with experimental results. Presents a careful discussion of the force fields used in the membrane simulations including detailed all-atom fields and coarse-grained fields. Presents a continuum description of membranes. Discusses a variety of issues such as influence of membrane surfaces on properties of water, interaction between membranes across water, nanoparticle permeation across the membrane, action of anesthetics and creation of inhomogeneous regions in membranes. Discusses important methodological issues when using simulations to examine phenomena such as pore creation and permeation across membranes. Discusses progress recently achieved in modeling bacterial membranes. It will be a valuable resource for graduate students, researchers and instructors in biochemistry, biophysics, pharmacology, physiology, and computational biology.
Handbook Of Research On Tools For Teaching Computational Thinking In P 12 Education
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Author : Kalogiannakis, Michail
language : en
Publisher: IGI Global
Release Date : 2020-06-26
Handbook Of Research On Tools For Teaching Computational Thinking In P 12 Education written by Kalogiannakis, Michail and has been published by IGI Global this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020-06-26 with Education categories.
While the growth of computational thinking has brought new awareness to the importance of computing education, it has also created new challenges. Many educational initiatives focus solely on the programming aspects, such as variables, loops, conditionals, parallelism, operators, and data handling, divorcing computing from real-world contexts and applications. This decontextualization threatens to make learners believe that they do not need to learn computing, as they cannot envision a future in which they will need to use it, just as many see math and physics education as unnecessary. The Handbook of Research on Tools for Teaching Computational Thinking in P-12 Education is a cutting-edge research publication that examines the implementation of computational thinking into school curriculum in order to develop creative problem-solving skills and to build a computational identity which will allow for future STEM growth. Moreover, the book advocates for a new approach to computing education that argues that while learning about computing, young people should also have opportunities to create with computing, which will have a direct impact on their lives and their communities. Featuring a wide range of topics such as assessment, digital teaching, and educational robotics, this book is ideal for academicians, instructional designers, teachers, education professionals, administrators, researchers, and students.