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020 a| 9781466561571 (hardcover : acid-free paper);

020 a| 1466561572 (hardcover : acid-free paper);

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245 00 a| Computational approaches to protein dynamicsh| [electronic resource] :b| from quantum to coarse-grained methods /c| edited by Mónika Fuxreiter.;

260 a| Boca Raton :b| CRC Press, Taylor & Francis Group,c| [2015];

300 a| xxvi, 453 pages :b| illustrations (some color);c| 24 cm.;

490 1 a| Series in computational biophysics;

504 a| Includes bibliographical references and index.;

505 0 a| Dynamics : a key to protein function / Mónika Fuxreiter -- Adaptive and accurate force-based QM/MM calculations / Noam Bernstein, Iván Solt, Letif Mones, Csilla Várnai, Steven A. Winfield, and Gábor Csányi -- Conformational and chemical landscapes of enzyme catalysis / Alexandra T. P. Carvalho, Fernanda Duarte, Konstantinos Vavitsas and Shina Caroline Lynn Kamerlin -- Interplay between enzyme function and protein dynamics : a multiscale approach to the study of the NAG kinase family and two class II aldolases / Enrique Marcos, Melchor Sanchez-Martinez, and Ramon Crehuet -- Simplified flexibility analysis of proteins / Yves-Henri Sanejouand -- ABSINTH implicit solvation model and force field paradigm for use in simulations of intrinsically disordered proteins / Anuradha Mittal, Rahul K. Das, Andreas Vitalis, and Rohit V. Pappu -- Intrinsically disordered protein : a thermodynamic perspective / Jing Li, James O. Wrabl, and Vincent J. Hilser -- Long molecular dynamics simulations of intrinsically disordered proteins reveal preformed structural elements for target binding / Elio Cino, Mikko Karttunen, and Wing-Yiu Choy -- Multiscale simulations of large conformational changes of disordered and ordered proteins induced by their partners / Yong Wang, Xiakun Chu, and Jin Wang -- Coarse-grained simulation of intrinsically disordered proteins / David de Sancho, Christopher M. Baker, and Robert B. Best -- Natural and directed evolution of intrinsically disordered proteins / Tali H. Reingewertz and Eric J. Sundberg -- Discrete molecular dynamics : foundations and biomolecular applications / Pedro Sfriso, Agustí Emperador, Josep Lluis Gelpí, and Modesto Orozco -- Use of ensemble methods to describe biomolecular dynamics by small angle x-ray scattering / Giancarlo Tria, Dmitri I. Svergun, and Pau Bernadó -- Bridging experiments and simulations : structure calculations with a dynamical touch / Florian Heinkel, Alexander Cumberworth, and Jörg Gsponer.;

506 a| Available only to authorized users.;

538 a| Mode of access: World Wide Web;

650 12 a| Protein Conformation.=| ^A923970;

650 22 a| Biophysical Phenomena.=| ^A1205500;

650 22 a| Computational Biologyx| methods.=| ^A932025;

650 22 a| Intrinsically Disordered Proteinsx| chemistry.=| ^A1337780;

650 22 a| Molecular Dynamics Simulation.=| ^A1337605;

650 22 a| Proteinsx| chemistry.=| ^A929572;

655 0 a| Electronic books.=| ^A491897;

700 1 a| Fuxreiter, Monika,d| 1969-=| ^A1330057;

830 0 a| Series in computational biophysics.?| UNAUTHORIZED;

856 40 z| Full text available from Ebook Central - Academic Completeu| https://ebookcentral.proquest.com/lib/eastcarolina/detail.action?docID=1684509;

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Computational approaches to protein dynamics from quantum to coarse-grained methods / edited by Mónika Fuxreiter.

Other author	Fuxreiter, Monika, 1969-
Format	Electronic
Publication Info	Boca Raton : CRC Press, Taylor & Francis Group, [2015]
Description	xxvi, 453 pages : illustrations (some color); 24 cm.
Supplemental Content	Full text available from Ebook Central - Academic Complete
Subjects	Protein Conformation. Biophysical Phenomena. Computational Biology--methods. Intrinsically Disordered Proteins--chemistry. Molecular Dynamics Simulation. Proteins--chemistry.

Series	Series in computational biophysics Series in computational biophysics. UNAUTHORIZED
Contents	Dynamics : a key to protein function / Mónika Fuxreiter -- Adaptive and accurate force-based QM/MM calculations / Noam Bernstein, Iván Solt, Letif Mones, Csilla Várnai, Steven A. Winfield, and Gábor Csányi -- Conformational and chemical landscapes of enzyme catalysis / Alexandra T. P. Carvalho, Fernanda Duarte, Konstantinos Vavitsas and Shina Caroline Lynn Kamerlin -- Interplay between enzyme function and protein dynamics : a multiscale approach to the study of the NAG kinase family and two class II aldolases / Enrique Marcos, Melchor Sanchez-Martinez, and Ramon Crehuet -- Simplified flexibility analysis of proteins / Yves-Henri Sanejouand -- ABSINTH implicit solvation model and force field paradigm for use in simulations of intrinsically disordered proteins / Anuradha Mittal, Rahul K. Das, Andreas Vitalis, and Rohit V. Pappu -- Intrinsically disordered protein : a thermodynamic perspective / Jing Li, James O. Wrabl, and Vincent J. Hilser -- Long molecular dynamics simulations of intrinsically disordered proteins reveal preformed structural elements for target binding / Elio Cino, Mikko Karttunen, and Wing-Yiu Choy -- Multiscale simulations of large conformational changes of disordered and ordered proteins induced by their partners / Yong Wang, Xiakun Chu, and Jin Wang -- Coarse-grained simulation of intrinsically disordered proteins / David de Sancho, Christopher M. Baker, and Robert B. Best -- Natural and directed evolution of intrinsically disordered proteins / Tali H. Reingewertz and Eric J. Sundberg -- Discrete molecular dynamics : foundations and biomolecular applications / Pedro Sfriso, Agustí Emperador, Josep Lluis Gelpí, and Modesto Orozco -- Use of ensemble methods to describe biomolecular dynamics by small angle x-ray scattering / Giancarlo Tria, Dmitri I. Svergun, and Pau Bernadó -- Bridging experiments and simulations : structure calculations with a dynamical touch / Florian Heinkel, Alexander Cumberworth, and Jörg Gsponer.
Bibliography note	Includes bibliographical references and index.
Access restriction	Available only to authorized users.
Technical details	Mode of access: World Wide Web
Genre/form	Electronic books.
LCCN	2015002490
ISBN	9781466561571 (hardcover : acid-free paper)
ISBN	1466561572 (hardcover : acid-free paper)

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Computational approaches to protein dynamics from quantum to coarse-grained methods / edited by Mónika Fuxreiter.

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