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OverviewThis volume seeks to understand biological processes by taking a multi-disciplinary approach, employing the tools of biology, chemistry and physics. These approaches focus on biomacromolecules and their functions, which includes how they interact and react, and how information is transmitted between them. The text concentrates on quantum mechanical simulation techniques, which have developed rapidly in recent years. This covers quantum mechanical calculations of large systems, molecular dynamics combining quantum and classical algorithms, quantum dynamical simulations, and electron-proton transfer processes in proteins and solutions. Full Product DetailsAuthor: Dominique Bicout , Martin FieldPublisher: Springer-Verlag Berlin and Heidelberg GmbH & Co. KG Imprint: Springer-Verlag Berlin and Heidelberg GmbH & Co. K Edition: 1996 ed. Volume: 4 Dimensions: Width: 17.00cm , Height: 1.80cm , Length: 24.40cm Weight: 0.568kg ISBN: 9783540608691ISBN 10: 3540608699 Pages: 311 Publication Date: 11 March 1996 Audience: College/higher education , Professional and scholarly , Postgraduate, Research & Scholarly , Professional & Vocational Format: Paperback Publisher's Status: Active Availability: Out of stock  The supplier is temporarily out of stock of this item. It will be ordered for you on backorder and shipped when it becomes available. Table of ContentsLecture 1 Density functional theory.- Lecture 2 Practical density functional approaches in chemistry and biochemistry.- Lecture 3 A quantum chemical view of the initial photochemical event in photosynthesis.- Lecture 4 Curve crossing in a protein: coupling of the elementary quantum process to motions of the protein.- Lecture 5 Quantum-classical molecular dynamics. Models and applications.- Lecture 6 Quantum dynamics simulation of a small quantum system embedded in a classical environment.- Lecture 7 A tubular view of electron transfer in azurin.- Lecture 8 Biological electron transfer: measurement, mechanism, engineering requirements.- Lecture 9 The photodetachment of an electron from a chloride ion in water studied by quantum molecular dynamics simulation.- Lecture 10 Quantum chemistry of in situ retinal: study of the spectral properties and dark adaptation of Bacteriorhodopsin.- Lecture 11 Towards an understanding of quantum factors in small ligand geminate recombination to heure proteins.- Lecture 12 A parallel direct SCF method for large molecular systems.- Lecture 13 Multigrid electrostatic computations in density functional theory.- Lecture 14 Symmetry-oriented research of polymers PC program POLSym and DNA.ReviewsAuthor InformationTab Content 6Author Website:Countries AvailableAll regions |
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