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Biomolecular Simulations, Luca Monticelli; Emppu Salonen


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Цена: 27950.00р.
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Автор: Luca Monticelli; Emppu Salonen
Название:  Biomolecular Simulations
ISBN: 9781493958917
Издательство: Springer
Классификация:

ISBN-10: 1493958917
Обложка/Формат: Paperback
Страницы: 702
Вес: 1.22 кг.
Дата издания: 23.08.2016
Серия: Methods in Molecular Biology
Язык: English
Издание: Softcover reprint of
Иллюстрации: 7 tables, black and white; xiii, 702 p.
Размер: 254 x 178 x 37
Читательская аудитория: General (us: trade)
Основная тема: Life Sciences
Подзаголовок: Methods and Protocols
Ссылка на Издательство: Link
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Поставляется из: Германии
Описание: Over the past 40 years the field of molecular simulations has evolved from picosecond studies of isolated macromolecules in vacuum to studies of complex, chemically heterogeneous biological systems consisting of millions of atoms, with the simulation time scales spanning up to milliseconds. In Biomolecular Simulations: Methods and Protocols, expert researchers illustrate many of the methods commonly used in molecular modelling of biological systems, including methods for electronic structure calculations, classical molecular dynamics simulations and coarse-grained techniques. A selection of advanced techniques and recent methodological developments, which rarely find coverage in traditional textbooks, is also introduced. Written in the highly successful Methods in Molecular Biology series format, chapters include general introductions to well-established computational methodologies, applications to real-world biological systems, as well as practical tips and general protocols on carrying out biomolecular simulations. Special emphasis is placed on simulations of proteins, lipids, nucleic acids, and carbohydrates. Authoritative and practical, Biomolecular Simulations: Methods and Protocols seeks to aid scientists in further simulation studies of biological systems.
Дополнительное описание: Ab initio, Density Functional Theory, and Semi-empirical Calculations.-Ab initio Molecular Dynamics.-Introduction to QM/MM simulations.-Computational Enzymology.-QM and QM/MM Simulations of Proteins.-Classical Molecular Dynamics in a Nutshell.-Enhanced Sa



Physics at the Biomolecular Interface

Автор: Fern?ndez
Название: Physics at the Biomolecular Interface
ISBN: 3319308513 ISBN-13(EAN): 9783319308517
Издательство: Springer
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Цена: 20896.00 р.
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Описание: This bookfocuses primarily on the role of interfacial forces in understanding biologicalphenomena at the molecular scale. By providing a suitable statisticalmechanical apparatus to handle the biomolecular interface, the book becomesuniquely positioned to address core problems in molecular biophysics. Ithighlights the importance of interfacial tension in delineating a solution tothe protein folding problem, in unravelling the physico-chemical basis ofenzyme catalysis and protein associations, and in rationally designingmolecular targeted therapies. Thus grounded in fundamental science, the bookdevelops a powerful technological platform for drug discovery, while it is setto inspire scientists at any level in their careers determined to address themajor challenges in molecular biophysics.Theacknowledgment of how exquisitely the structure and dynamics of proteins and theiraqueous environment are related attests to the overdue recognition thatbiomolecular phenomena cannot be effectively understood without dealing withinterfacial behaviour. There is an urge to grasp how biologically relevantbehaviour is shaped by the structuring of biomolecular interfaces and howinterfacial tension affects the molecular events that take place in the cell.This book squarely addresses these needs from a physicist perspective.Thebook may serve as a monograph for practitioners and, alternatively, as anadvanced textbook. Fruitful reading requires a background in physical chemistryand some basics in biophysics. The selected problems at the end of the chaptersand the progression in conceptual difficulty make it a suitable textbook for agraduate level course or an elective course for seniors majoring in chemistry,physics, biomedical engineering or related disciplines.

Biomolecular Forms And Functions: A Celebration Of 50 Years Of The Ramachandran Map

Автор: Bansal Manju & Srinivasan N
Название: Biomolecular Forms And Functions: A Celebration Of 50 Years Of The Ramachandran Map
ISBN: 981444913X ISBN-13(EAN): 9789814449137
Издательство: World Scientific Publishing
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Цена: 26136.00 р.
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Описание: Understanding the functions and properties of molecules in living systems requires a detailed knowledge of their three-dimensional structures and the conformational variability that allows them to adopt multiple functional forms. Interpreting biological systems in the language of three-dimensional structures is of fundamental importance and innumerable research groups around the world are working in this area. This book is a compilation of articles describing attempts at understanding the intricacies of biological systems through the structures of and interactions between their constituent molecules.


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