Exploring Life Phenomena With Statistical Mechanics Of Molecular Liquids
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Exploring Life Phenomena With Statistical Mechanics Of Molecular Liquids
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Author : Fumio Hirata
language : en
Publisher: CRC Press
Release Date : 2020-02-12
Exploring Life Phenomena With Statistical Mechanics Of Molecular Liquids written by Fumio Hirata and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020-02-12 with History categories.
In a living body, a variety of molecules are working in a concerted manner to maintain its life, and to carry forward the genetic information from generation to generation. A key word to understand such processes is "water," which plays an essential role in life phenomena. This book sheds light on life phenomena, which are woven by biomolecules as warp and water as weft, by means of statistical mechanics of molecular liquids, the RISM and 3D-RISM theories, both in equilibrium and non-equilibrium. A considerable number of pages are devoted to basics of mathematics and physics, so that students who have not majored in physics may be able to study the book by themselves. The book will also be helpful to those scientists seeking better tools for the computer-aided-drug-discovery. Explains basics of the statistical mechanics of molecular liquids, or RISM and 3D-RISM theories, and its application to water. Provides outline of the generalized Langevin theory and the linear response theory, and its application to dynamics of water. Applies the theories to functions of biomolecular systems. Applies the theories to the computer aided drug design. Provides a perspective for future development of the method.
Molecular Theory Of Fluctuation In Life Phenomena
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Author : Fumio Hirata
language : en
Publisher: Springer Nature
Release Date : 2025-04-24
Molecular Theory Of Fluctuation In Life Phenomena written by Fumio Hirata and has been published by Springer Nature this book supported file pdf, txt, epub, kindle and other format this book has been release on 2025-04-24 with Science categories.
This book describes molecular processes taking place in living cells, in which “water” or “solvation” play essential roles. The molecular processes include conformational stability, fluctuation, relaxation, self-organization, molecular recognition, and chemical reactions. In all those processes, so-called solvation free-energy, and its first and second derivatives with respect to the atomic coordinates of biomolecules play key roles. Such derivatives of the free energy may not be calculated by any method of molecular simulation, because the calculation requires an analytical formula of the solvation free energy as a function of the atomic coordinates of a biomolecule. In this book, the theory is applied to analyze phenomena closely related to the conformational and density fluctuation of biomolecular systems, including the entropy and spectroscopy of both biomolecules and solvents. The theory is further developed to give microscopic expressions to the well-regarded phenomenological theories of chemical reactions, including the Michaelis–Menten theory of the enzymatic reaction, and the theory of the electron-transfer reaction by R. Marcus. Also clarified in the book is physical basis of Anfinsen’s hypothesis concerning the protein folding. This book is beneficial for graduate students and researchers in the field of life science and technology, especially for those studying pharmaceutical design and biomimetic technology such as artificial enzymes.
Classical And Molecular Thermodynamics Of Fluid Systems
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Author : Juan H. Vera
language : en
Publisher: CRC Press
Release Date : 2024-11-14
Classical And Molecular Thermodynamics Of Fluid Systems written by Juan H. Vera and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2024-11-14 with Science categories.
This text explores the connections between different thermodynamic subjects related to fluid systems. In an innovative way, it covers the subject from first principles to the state of the art in fundamental and applied topics. Using simple nomenclature and algebra, it clarifies concepts by returning to the conceptual foundation of thermodynamics. The structural elements of classical and molecular thermodynamics of fluid systems presented cover, via examples and references, both the usefulness and the limitations of thermodynamics for the treatment of practical problems. This new edition explores recent advances in statistical associated fluid theories and contains creative end‐of‐chapter problems connecting the theory with real‐life situations. It includes new chapters on thermodynamics of polymer solutions and molecular thermodynamics and also presents advances in the study of the activity of individual ions. Provides a concise structure of concepts, using simple nomenclature and algebra Clarifies problems usually overlooked by standard texts Features end‐of‐chapter problems to enhance the reader’s understanding of the concepts Includes diverse topics of interest to researchers and advanced students, including elements of statistical thermodynamics, models of solutions, statistical associated fluid theory and the activity of individual ions Offers four appendices giving step‐by‐step procedures and parameters for direct use of the PRSV equation of state and the ASOG‐KT group method for fugacity and activity coefficient calculations Features a complete set of solutions to problems throughout the book, available for download on the book’s webpage under "Support Material" This textbook is written for advanced undergraduate and graduate students studying chemical engineering and chemistry as well as for practicing engineers and researchers.
Fundamentals And Practice In Statistical Thermodynamics
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Author : Jianzhong Wu
language : en
Publisher: John Wiley & Sons
Release Date : 2024-07-17
Fundamentals And Practice In Statistical Thermodynamics written by Jianzhong Wu and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2024-07-17 with Technology & Engineering categories.
Bridge the gap between thermodynamic theory and engineering practice with this essential textbook Thermodynamics is a discipline which straddles the fields of chemistry, physics, and engineering, and has long been a mainstay of undergraduate and graduate curricula. Conventional thermodynamics courses, however, often ignore modern developments in statistical mechanics, such as molecular simulation methods, cooperative phenomena, phase transitions, universality, as well as liquid-state and polymer theories, despite their close relevance to both fundamental research and engineering practice. Fundamentals and Practice in Statistical Thermodynamics fills this gap with an essential book that applies up-to-date statistical-mechanical techniques to address the most crucial thermodynamics problems found in chemical and materials systems. It is ideally suited to introduce a new generation of researchers and molecular engineers to modern thermodynamic topics with numerous cutting-edge applications. From Fundamentals and Practice in Statistical Thermodynamics readers will also find: An introduction to statistical-mechanical methods including molecular dynamics simulation, Monte Carlo simulation, as well as the molecular theories of phase transitions, classical fluids, electrolyte solutions, polymeric materials, and more Illustrative examples and exercise problems with solutions to facilitate student understanding Supplementary online materials covering the basics of quantum mechanics, density functional theory, variational principles of classical mechanics, intermolecular interactions, and many more subjects Fundamentals and Practice in Statistical Thermodynamics is ideal for graduate and advanced undergraduate students in chemical engineering, biomolecular engineering, environmental engineering, materials science and engineering, and all related scientific subfields of physics and chemistry.
Water And Biomolecules
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Author : Kunihiro Kuwajima
language : en
Publisher: Springer Science & Business Media
Release Date : 2009-03-18
Water And Biomolecules written by Kunihiro Kuwajima and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2009-03-18 with Science categories.
Life is produced by the interplay of water and biomolecules. This book deals with the physicochemical aspects of such life phenomena produced by water and biomolecules, and addresses topics including "Protein Dynamics and Functions", "Protein and DNA Folding", and "Protein Amyloidosis". All sections have been written by internationally recognized front-line researchers. The idea for this book was born at the 5th International Symposium "Water and Biomolecules", held in Nara city, Japan, in 2008.
Innovative Physical Chemistry Perspectives
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Author : Praveen Kaushik
language : en
Publisher: Educohack Press
Release Date : 2025-02-20
Innovative Physical Chemistry Perspectives written by Praveen Kaushik and has been published by Educohack Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2025-02-20 with Science categories.
"Innovative Physical Chemistry Perspectives" offers a refreshing take on traditional concepts in physical chemistry, presenting them through innovative approaches, modern applications, and interdisciplinary insights. Authored by experts, this comprehensive volume explores fundamental principles and cutting-edge research topics, inviting readers to engage with the dynamic and evolving landscape of physical chemistry. Each chapter delves into specific aspects, providing in-depth discussions, theoretical foundations, and practical examples. From nanochemistry and biomolecular interactions to quantum mechanics and statistical mechanics, we cover a wide range of topics, highlighting the interconnectedness of various subfields and their relevance to real-world phenomena. Through clear explanations, illustrative examples, and thought-provoking discussions, "Innovative Physical Chemistry Perspectives" aims to inspire curiosity, critical thinking, and a deeper appreciation for the complexities of matter and energy at the molecular level. Whether you're a student, researcher, or enthusiast in the field, this book serves as a valuable resource for expanding your knowledge and understanding. With its emphasis on modern perspectives, interdisciplinary approaches, and practical applications, "Innovative Physical Chemistry Perspectives" is set to become an essential reference for anyone seeking to explore physical chemistry from new and exciting angles.
Cornell University Courses Of Study
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Author : Cornell University
language : en
Publisher:
Release Date : 2005
Cornell University Courses Of Study written by Cornell University and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2005 with Universities and colleges categories.
Statistical Mechanics
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Author : R. K. Pathria
language : en
Publisher: Elsevier
Release Date : 2016-06-30
Statistical Mechanics written by R. K. Pathria and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2016-06-30 with Technology & Engineering categories.
International Series in Natural Philosophy, Volume 45: Statistical Mechanics discusses topics relevant to explaining the physical properties of matter in bulk. The book is comprised of 13 chapters that primarily focus on the equilibrium states of physical systems. Chapter 1 discusses the statistical basis of thermodynamics, and Chapter 2 covers the elements of ensemble theory. Chapters 3 and 4 tackle the canonical and grand canonical ensemble. Chapter 5 deals with the formulation of quantum statistics, while Chapter 6 reviews the theory of simple gases. Chapters 7 and 8 discuss the ideal Bose and Fermi systems. The book also covers the cluster expansion, pseudopotential, and quantized field methods. The theory of phase transitions and fluctuations are then discussed. The text will be of great use to researchers who wants to utilize statistical mechanics in their work.
Annual Review
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Author : 岡崎国立共同研究機構分子科学研究所
language : en
Publisher:
Release Date : 2002
Annual Review written by 岡崎国立共同研究機構分子科学研究所 and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2002 with Molecular structure categories.
Evolutionary Dynamics
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Author : James Patrick Crutchfield
language : en
Publisher:
Release Date : 2003
Evolutionary Dynamics written by James Patrick Crutchfield and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2003 with Science categories.
The 14 chapters of this volume, which present an overview of new research in evolutionary dynamics, were first presented at a conference held in October 1998 at the Santa Fe Institute. The main divisions of the book are macroevolution; epochal evolution; population genetics, dynamics, and optimization; and evolution of cooperation. Individual topics include spectral landscape theory, external triggers in biological evolution, and evolutionary dynamics of asexual reproduction. Several of the contributors, like the editors, are affiliated with the Sante Fe Institute; others teach or work in physics, genetics, biology, computational neuroscience, and theoretical chemistry at universities and private institutions in the US, UK, Austria, Sweden, Australia, Israel, and Germany. Annotation copyrighted by Book News, Inc., Portland, OR