Introduction Markov State Models (21 results)
Language: English
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Taschenbuch. Condition: Neu. An Introduction to Markov State Models and Their Application to Long Timescale Molecular Simulation | Gregory R. Bowman (u. a.) | Taschenbuch | Advances in Experimental Medicine and Biology | xii | Englisch | 2016 | Springer | EAN 9789402407624 | Verantwortliche Person für die EU: Springer Verlag Gmb…H, Tiergartenstr. 17, 69121 Heidelberg, juergen[dot]hartmann[at]springer[dot]com | Anbieter: preigu.
Language: English
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Taschenbuch. Condition: Neu. Druck auf Anfrage Neuware - Printed after ordering - The aim of this book volume is to explain the importance of Markov state models to molecular simulation, how they work, and how they can be applied to a range of problems.The Markov state model (MSM) approach aims to address two key challenges of m…olecular simulation:1) How to reach long timescales using short simulations of detailed molecular models.2) How to systematically gain insight from the resulting sea of data.MSMs do this by providing a compact representation of the vast conformational space available to biomolecules by decomposing it into states sets of rapidly interconverting conformations and the rates of transitioning between states. This kinetic definition allows one to easily vary the temporal and spatial resolution of an MSM from high-resolution models capable of quantitative agreement with (or prediction of) experiment to low-resolution models that facilitate understanding. Additionally, MSMs facilitate the calculation of quantities that are difficult to obtain from more direct MD analyses, such as the ensemble of transition pathways.This book introduces the mathematical foundations of Markov models, how they can be used to analyze simulations and drive efficient simulations, and some of the insights these models have yielded in a variety of applications of molecular simulation.
Language: English
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Buch. Condition: Neu. Druck auf Anfrage Neuware - Printed after ordering - The aim of this book volume is to explain the importance of Markov state models to molecular simulation, how they work, and how they can be applied to a range of problems.The Markov state model (MSM) approach aims to address two key challenges of molecula…r simulation:1) How to reach long timescales using short simulations of detailed molecular models.2) How to systematically gain insight from the resulting sea of data.MSMs do this by providing a compact representation of the vast conformational space available to biomolecules by decomposing it into states sets of rapidly interconverting conformations and the rates of transitioning between states. This kinetic definition allows one to easily vary the temporal and spatial resolution of an MSM from high-resolution models capable of quantitative agreement with (or prediction of) experiment to low-resolution models that facilitate understanding. Additionally, MSMs facilitate the calculation of quantities that are difficult to obtain from more direct MD analyses, such as the ensemble of transition pathways.This book introduces the mathematical foundations of Markov models, how they can be used to analyze simulations and drive efficient simulations, and some of the insights these models have yielded in a variety of applications of molecular simulation.
An Introduction to Markov State Models and Their Application to Long Timescale Molecular Simulation
Bowman, Gregory R. (Editor)/ Pande, Vijay S. (Editor)/ Noé, Frank (Editor)
Language: English
Published by Springer Verlag, 2013
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Hardcover. Condition: Brand New. 2014 edition. 139 pages. 9.25x6.25x0.50 inches. In Stock.
An Introduction to Markov State Models and Their Application to Long Timescale Molecular Simulation (Advances in Experimental Medicine and Biology)
Bowman, Gregory R. (Editor) / Pande, Vijay S. (Editor) / Noé, Frank (Editor)
Language: English
Published by Springer, 2016
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Paperback. Condition: Brand New. reprint edition. 152 pages. 9.25x6.10x0.36 inches. In Stock.
Language: English
Published by Springer, 2013
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Published by Springer Netherlands, 2016
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Condition: New. Dieser Artikel ist ein Print on Demand Artikel und wird nach Ihrer Bestellung fuer Sie gedruckt. In-depth review of the mathematical underpinnings of Markov state modelsPractical insight into applying Markov state models to molecular systemsPoints readers to freely available software for constructing Markov state… modelsThe a.
Language: English
Published by Springer Netherlands, 2013
Series: Advances in Experimental Medicine and Biology, Book 157 of 544. Book 157 of 544 - Advances in Experimental Medicine and Biology
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Gebunden. Condition: New. Dieser Artikel ist ein Print on Demand Artikel und wird nach Ihrer Bestellung fuer Sie gedruckt. In-depth review of the mathematical underpinnings of Markov state modelsPractical insight into applying Markov state models to molecular systemsPoints readers to freely available software for constructing Ma…rkov state modelsThe a.
Language: English
Published by Springer Netherlands, Springer Netherlands Sep 2016, 2016
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Taschenbuch. Condition: Neu. This item is printed on demand - it takes 3-4 days longer - Neuware -The aim of this book volume is to explain the importance of Markov state models to molecular simulation, how they work, and how they can be applied to a range of problems.The Markov state model (MSM) approach aims to address two key… challenges of molecular simulation:1) How to reach long timescales using short simulations of detailed molecular models.2) How to systematically gain insight from the resulting sea of data.MSMs do this by providing a compact representation of the vast conformational space available to biomolecules by decomposing it into states sets of rapidly interconverting conformations and the rates of transitioning between states. This kinetic definition allows one to easily vary the temporal and spatial resolution of an MSM from high-resolution models capable of quantitative agreement with (or prediction of) experiment to low-resolution models that facilitate understanding. Additionally, MSMs facilitate the calculation of quantities that are difficult to obtain from more direct MD analyses, such as the ensemble of transition pathways.This book introduces the mathematical foundations of Markov models, how they can be used to analyze simulations and drive efficient simulations, and some of the insights these models have yielded in a variety of applications of molecular simulation. 152 pp. Englisch.
Language: English
Published by Springer Netherlands, Springer Netherlands Dez 2013, 2013
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Buch. Condition: Neu. This item is printed on demand - it takes 3-4 days longer - Neuware -The aim of this book volume is to explain the importance of Markov state models to molecular simulation, how they work, and how they can be applied to a range of problems.The Markov state model (MSM) approach aims to address two key challe…nges of molecular simulation:1) How to reach long timescales using short simulations of detailed molecular models.2) How to systematically gain insight from the resulting sea of data.MSMs do this by providing a compact representation of the vast conformational space available to biomolecules by decomposing it into states sets of rapidly interconverting conformations and the rates of transitioning between states. This kinetic definition allows one to easily vary the temporal and spatial resolution of an MSM from high-resolution models capable of quantitative agreement with (or prediction of) experiment to low-resolution models that facilitate understanding. Additionally, MSMs facilitate the calculation of quantities that are difficult to obtain from more direct MD analyses, such as the ensemble of transition pathways.This book introduces the mathematical foundations of Markov models, how they can be used to analyze simulations and drive efficient simulations, and some of the insights these models have yielded in a variety of applications of molecular simulation. 152 pp. Englisch.
Language: English
Published by Springer, Springer Dez 2013, 2013
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Buch. Condition: Neu. This item is printed on demand - Print on Demand Titel. Neuware -The aim of this book volume is to explain the importance of Markov state models to molecular simulation, how they work, and how they can be applied to a range of problems.The Markov state model (MSM) approach aims to address two key challenges… of molecular simulation:1) How to reach long timescales using short simulations of detailed molecular models.2) How to systematically gain insight from the resulting sea of data.MSMs do this by providing a compact representation of the vast conformational space available to biomolecules by decomposing it into states sets of rapidly interconverting conformations and the rates of transitioning between states.This kinetic definition allows one to easily vary the temporal and spatial resolution of an MSM from high-resolution models capable of quantitative agreement with (or prediction of) experiment to low-resolution models that facilitate understanding. Additionally, MSMs facilitate the calculation of quantities that are difficult to obtain from more direct MD analyses, such as the ensemble of transition pathways.This book introduces the mathematical foundations of Markov models, how they can be used to analyze simulations and drive efficient simulations, and some of the insights these models have yielded in a variety of applications of molecular simulation.Springer-Verlag KG, Sachsenplatz 4-6, 1201 Wien 152 pp. Englisch.
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Published by Springer, Springer Sep 2016, 2016
Series: Advances in Experimental Medicine and Biology, Book 157 of 544. Book 157 of 544 - Advances in Experimental Medicine and Biology
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Taschenbuch. Condition: Neu. This item is printed on demand - Print on Demand Titel. Neuware -The aim of this book volume is to explain the importance of Markov state models to molecular simulation, how they work, and how they can be applied to a range of problems.The Markov state model (MSM) approach aims to address two key cha…llenges of molecular simulation:1) How to reach long timescales using short simulations of detailed molecular models.2) How to systematically gain insight from the resulting sea of data.MSMs do this by providing a compact representation of the vast conformational space available to biomolecules by decomposing it into states sets of rapidly interconverting conformations and the rates of transitioning between states.This kinetic definition allows one to easily vary the temporal and spatial resolution of an MSM from high-resolution models capable of quantitative agreement with (or prediction of) experiment to low-resolution models that facilitate understanding. Additionally, MSMs facilitate the calculation of quantities that are difficult to obtain from more direct MD analyses, such as the ensemble of transition pathways.This book introduces the mathematical foundations of Markov models, how they can be used to analyze simulations and drive efficient simulations, and some of the insights these models have yielded in a variety of applications of molecular simulation.Springer-Verlag KG, Sachsenplatz 4-6, 1201 Wien 152 pp. Englisch.
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Published by Springer, 2016
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