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Computational Methods to Study the Structure and Dynamics of Biomolecules and Biomolecular Processes
Since the second half of the 20th century machine computations have played a critical role in science and engineering. Computer-based techniques have become especially important in molecular biology, since they often represent the only viable way to gain insights into the behavior of a biological system as a whole. The complexity of biological systems, which usually needs to be analyzed on different time- and size-scales and with different levels of accuracy, requires the application of different approaches, ranging from comparative analysis of sequences and structural databases, to the analysis of networks of interdependence between cell components and processes, through coarse-grained mode...
Transition Metals in Coordination Environments
This book focuses on the electronic properties of transition metals in coordination environments. These properties are responsible for the unique and intricate activity of transition metal sites in bio- and inorganic catalysis, but also pose challenges for both theoretical and experimental studies. Written by an international group of recognized experts, the book reviews recent advances in computational modeling and discusses their interplay using experiments. It covers a broad range of topics, including advanced computational methods for transition metal systems; spectroscopic, electrochemical and catalytic properties of transition metals in coordination environments; metalloenzymes and biomimetic compounds; and spin-related phenomena. As such, the book offers an invaluable resource for all researchers and postgraduate students interested in both fundamental and application-oriented research in the field of transition metal systems.
Computational Chemistry
Computational Chemistry, Volume 73, the latest release in the Advances in Inorganic Chemistry series, presents timely and informative summaries on current progress in a variety of subject areas. This acclaimed serial features reviews written by experts in the field, serving as an indispensable reference to advanced researchers that empowers readers to pursue new developments in each field. Users will find this to be a comprehensive overview of recent findings and trends from the last decade that covers various kinds of inorganic topics, from theoretical oriented supramolecular chemistry, to the quest for accurate calculations of spin states in transition metals. - Features comprehensive reviews on the latest developments in computational studies in inorganic chemistry - Includes contributions from leading experts in the field of inorganic reaction mechanisms - Serves as an indispensable reference to advanced researchers in many related fields
Reviews in Computational Chemistry, Volume 27
This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Volume 27 covers brittle fracture, molecular detailed simulations of lipid bilayers, semiclassical bohmian dynamics, dissipative particle dynamics, trajectory-based rare event simulations, and understanding metal/metal electrical contact conductance from the atomic to continuum scales. Also included is a chapter on career opportunities in computational chemistry and an appendix listing the e-mail addresses of more than 2500 people in that discipline. FROM REVIEWS OF THE SERIES "Reviews in Computational Chemistry remains the most valuable reference to methods and techniques in computational chemistry." —JOURNAL OF MOLECULAR GRAPHICS AND MODELLING "One cannot generally do better than to try to find an appropriate article in the highly successful Reviews in Computational Chemistry. The basic philosophy of the editors seems to be to help the authors produce chapters that are complete, accurate, clear, and accessible to experimentalists (in particular) and other nonspecialists (in general)." —JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
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Computational Collective Intelligence. Technologies and Applications
The two volumes set LNCS 7653 and 7654 constitutes the refereed proceedings of the 4th International Conference on Computational Collective Intelligence, ICCCI, held in Ho Chi Minh City, Vietnam, in November 2012. The 113 revised full papers presented were carefully reviewed and selected from 397 submissions. The papers are organized in topical sections on (Part I) knowledge integration; data mining for collective processing; fuzzy, modal, and collective systems; nature inspired systems; language processing systems; social networks and semantic web; agent and multi-agent systems; classification and clustering methods; modeling and optimization techniques for business intelligence; (Part II) multi-dimensional data processing; web systems; intelligent decision making; methods for scheduling; collective intelligence in web systems – web systems analysis; advanced data mining techniques and applications; cooperative problem solving; computational swarm intelligence; and semantic methods for knowledge discovery and communication
Limited Edition of One
The more I thought about it, the more I realised my career has been unusual. How did I manage to do everything wrong but still end up on the front cover of magazines, headlining world tours and achieving Top 5 albums? How did I attract such obsessive and fanatical fans, many of whom take everything I do or say very personally, which is simultaneously flattering but can also be tremendously frustrating? Even this I somehow cultivated without somehow meaning to. My accidental career. Limited Edition of One is unlike any other music book you will ever have read. Part the long-awaited memoir of Steven Wilson: whose celebrated band Porcupine Tree began as teenage fiction before unintentionally ev...
