International Tables For Crystallography Volume F

Author : Michael G. Rossmann,Edward V. Arnold
Publisher : Springer
Page : 128 pages
File Size : 48,8 Mb
Release : 2010-04-15
Category : Science
ISBN : 1402092741

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International Tables for Crystallography,Volume F: by Michael G. Rossmann,Edward V. Arnold Pdf

International Tables for Crystallography are no longer available for purchase from Springer. For further information please contact Wiley Inc. International Tables for Crystallography, Volume F, Crystallography of biological macromolecules is an expert guide to macromolecular crystallography for the modern structural biologist. It was commissioned by the International Union of Crystallography in recognition of the extraordinary contributions that knowledge of macromolecular structure has made, and will make, to the analysis of biological systems, from enzyme catalysis to the workings of a whole cell, and to the growing field of structural genomics. The volume covers all stages of a crystallographic analysis from the preparation of samples using the techniques of molecular biology, through crystallization, diffraction data collection, phase determination, structure validation and structure analysis. Although the book is written for experienced scientists, it is recognized that the reader is more likely to be a biologist interested in structure than a classical crystallographer interested in biology. Thus there are chapters on the fundamentals, history and current perspectives of macromolecular crystallography, as well as the availability of useful programs and databases including the Protein Data Bank. Each chapter is written by an internationally recognized expert.

Author : Uri Shmueli
Publisher : Springer Science & Business Media
Page : 704 pages
File Size : 41,6 Mb
Release : 2008-08-27
Category : Science
ISBN : 1402082053

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International Tables for Crystallography, Volume B by Uri Shmueli Pdf

International Tables for Crystallography are no longer available for purchase from Springer. For further information please contact Wiley Inc. (follow the link on the right hand side of this page). Volume B presents accounts of the numerous aspects of reciprocal space in crystallographic research. After an introductory chapter, Part 1 presents the reader with an account of structure-factor formalisms, an extensive treatment of the theory, algorithms and crystallographic applications of Fourier methods, and fundamental as well as advanced treatments of symmetry in reciprocal space. In Part 2, these general accounts are followed by detailed expositions of crystallographic statistics, the theory of direct methods, Patterson techniques, isomorphous replacement and anomalous scattering, and treatments of the role of electron microscopy and diffraction in crystal structure determination, including applications of direct methods to electron crystallography. Part 3 deals with applications of reciprocal space to molecular geometry and `best'-plane calculations, and contains a treatment of the principles of molecular graphics and modelling and their applications. A convergence-acceleration method of importance in the computation of approximate lattice sums is presented and the part concludes with a discussion of the Ewald method. Part 4 contains treatments of various diffuse-scattering phenomena arising from crystal dynamics, disorder and low dimensionality (liquid crystals), and an exposition of the underlying theories and/or experimental evidence. Polymer crystallography and reciprocal-space images of aperiodic crystals are also treated. Part 5 of the volume contains introductory treatments of the theory of the interaction of radiation with matter (dynamical theory) as applied to X-ray, electron and neutron diffraction techniques. The simplified trigonometric expressions for the structure factors in the 230 three-dimensional space groups, which appeared in Volume I of International Tables for X-ray Crystallography, are now given in Appendix 1.4.3 to Chapter 1.4 of this volume. Volume B is a vital addition to the library of scientists engaged in crystal structure determination, crystallographic computing, crystal physics and other fields of crystallographic research. Graduate students specializing in crystallography will find much material suitable for self-study and a rich source of references to the relevant literature.

Author : A.J.C. Wilson,E. Prince
Publisher : Springer
Page : 1000 pages
File Size : 50,7 Mb
Release : 1999-06-30
Category : Science
ISBN : 0792352688

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International Tables for Crystallography, Volume C by A.J.C. Wilson,E. Prince Pdf

International Tables for Crystallography are no longer available for purchase from Springer. For further information please contact Wiley Inc. The purpose of Volume C is to provide the mathematical, physical, and chemical information needed for experimental studies in structural crystallography. This new edition features two completely new chapters, on reflectometry and neutron topography. More than half of the text has been revised and updated, and there are extensive updates and corrections to tabular material. Volume C covers all aspects of experimental techniques, using all three principal radiation types, from the selection and mounting of crystals and production of radiation through data collection and analysis to interpretation of results. Audience: The volume is an essential source of information for all workers using crystallographic techniques in physics, chemistry, metallurgy, earth sciences, and molecular biology.

Author : International Union of Crystallography
Publisher : Springer
Page : 540 pages
File Size : 52,9 Mb
Release : 1993-06-30
Category : Science
ISBN : UOM:39015031883922

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International Tables for Crystallography, Volume B by International Union of Crystallography Pdf

International Tables for Crystallography are no longer available for purchase from Springer. For further information please contact Wiley Inc. The general purpose of Volume B of the International Tables for Crystallography is to present the user/reader with competent and useful accounts of the numerous aspects of reciprocal space in crystallographic research. After an introductory chapter, Part 1 presents the reader with an account of structure factor formalisms, an extensive treatment of the theory, algorithms and crystallographic applications of Fourier methods and a treatment of symmetry in reciprocal space. In Part 2 of the volume these general accounts are followed by detailed expositions of crystallographic statistics, direct methods, Patterson techniques, isomorphous replacement and anomalous scattering, and treatments of the role of electron microscopy and diffraction in crystal structure determination. Part 3 deals with applications of reciprocal space to molecular geometry and `best' plane calculations; it contains a treatment of the principles of molecular graphics and modelling and their applications, and concludes with the presentation of a convergence-acceleration method, of importance in the computation of approximate crystal potentials. The fourth Part contains treatments of various diffuse scattering phenomena arising from crystal dynamics, disorder and low dimensionality (liquid crystals), and an exposition of the underlying theories and/or experimental evidence. The volume concludes with an introductory treatment of the theory of interaction of radiation with matter, the so-called dynamical theory. Insofar as it was possible, effects due to all three major diffraction techniques (X-rays, neutrons and electrons) are considered. The volume is a vital addition to the library of scientists engaged in crystal structure determination, crystallographic computing, crystal physics and other fields of crystallogaphic research. Graduate students specializing in crystallography will find much material suitable for self study and a rich source of references to the relevant literature.

Author : Christopher Chantler,Bruce Bunker,Federico Boscherini
Publisher : John Wiley & Sons
Page : 1090 pages
File Size : 51,8 Mb
Release : 2024-08-19
Category : Science
ISBN : 9781119433941

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International Tables for Crystallography, Volume I by Christopher Chantler,Bruce Bunker,Federico Boscherini Pdf

X-ray absorption spectroscopy and X-ray emission spectroscopy are complementary to crystallographic methods, particularly for materials science and the study of nanostructure and systems with partial disorder and partial local order, including solutions, gases, liquids, glasses and powders. This new volume of International Tables for Crystallography has nine parts and over 150 chapters contributed by a wide range of international experts. Part 1 provides a brief overview and introduction to the background of X-ray absorption spectroscopy (XAS) and experimental facilities. Part 2 discusses the quantum theory of XAS and related approaches. Part 3 describes both standard and advanced experimental methods used in XAS, X-ray emission spectroscopy (XES) and related techniques. Part 4 covers both standard and more advanced pre-processing of data. Part 5 gives an extensive overview of the analysis of experimental data. Part 6 provides details of the major software packages for data collection, reduction and analysis. Part 7 outlines the importance in science, reporting and hypothesis testing of the exchange of input and processed output data, and data deposition. It also presents excerpts of tables of data and supplementary material for XAS, pre-edge studies, X-ray absorption near-edge spectroscopy (XANES) and X-ray absorption fine structure (XAFS) studies. These tables are also available in full as online supporting information. Part 8 explores a wide range of applications of XAS in fields including materials science, physics, chemistry, biology, earth sciences, catalysis and cultural heritage. Part 9 presents definitions of the terms and quantities used, as developed by the International Union of Crystallography's Commission on XAFS. The volume has been written for the worldwide XAS community of thousands of practitioners, beamline scientists, experts and academics, and for the novice user who wishes to know what XAS and XES can do for them and how they may use these techniques for their particular purposes. The volume is therefore intended to be a self-contained, authoritative reference work that can also be used for training, learning or teaching, providing practical guidance for readers of all levels of experience. More information on the volumes in the series International Tables for Crystallography can be found at https://it.iucr.org.

Author : E. Prince
Publisher : Springer Science & Business Media
Page : 1033 pages
File Size : 54,7 Mb
Release : 2004-01-31
Category : Science
ISBN : 9781402019005

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International Tables for Crystallography,Volume C by E. Prince Pdf

International Tables for Crystallography are no longer available for purchase from Springer. For further information please contact Wiley Inc. (follow the link on the right hand side of this page). The purpose of Volume C is to provide the mathematical, physical and chemical information needed for experimental studies in structural crystallography. The volume covers all aspects of experimental techniques, using all three principal radiation types, from the selection and mounting of crystals and production of radiation, through data collection and analysis, to interpretation of results. As such, it is an essential source of information for all workers using crystallographic techniques in physics, chemistry, metallurgy, earth sciences and molecular biology.

Author : C. P. Brock
Publisher : Wiley
Page : 0 pages
File Size : 44,9 Mb
Release : 2014-11-17
Category : Science
ISBN : 1119050324

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International Tables for Crystallography, 8 Volume Set (updated September 2014) by C. P. Brock Pdf

International Tables for Crystallography is the definitive resource and reference work for crystallography and structural science. Each of the eight volumes in the series contains articles and tables of data relevant to crystallographic research and to applications of crystallographic methods in all sciences concerned with the structure and properties of materials. Emphasis is given to symmetry, diffraction methods and techniques of crystal-structure determination, and the physical and chemical properties of crystals. The data are accompanied by discussions of theory, practical explanations and examples, all of which are useful for teaching. International Tables for Crystallography comprises more than 6,000 pages including nearly 2,000 pages of symmetry tables which are vital for the analysis of crystal structures: Volume A: Space-group symmetry, 5e Volume A1: Symmetry relations between space groups, 2e Volume B: Reciprocal space, 3e Volume C: Mathematical, physical and chemical tables, 3e Volume D: Physical properties of crystals, 2e Volume E: Subperiodic groups, 2e Volume F: Crystallography of biological macromolecules, 2e Volume G: Definition and exchange of crystallographic data This edition includes a new edition of Volume D, making International Tables the most up-to-date, dynamic, and comprehensive reference work available to crystallographers, and to all those who use crystallography across a wide range of fields.

Author : Theo Hahn
Publisher : Unknown
Page : 0 pages
File Size : 47,6 Mb
Release : 1983
Category : Crystallography
ISBN : LCCN:83003416

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International Tables for Crystallography: Space-group symmetry by Theo Hahn Pdf

Author : Sydney Hall,Brian McMahon
Publisher : John Wiley & Sons
Page : 611 pages
File Size : 50,5 Mb
Release : 2005-10-07
Category : Science
ISBN : 9780470689103

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International Tables for Crystallography, Definition and Exchange of Crystallographic Data by Sydney Hall,Brian McMahon Pdf

International Tables for Crystallography is the definitive resource and reference work for crystallography and structural science. Each of the volumes in the series contains articles and tables of data relevant to crystallographic research and to applications of crystallographic methods in all sciences concerned with the structure and properties of materials. Emphasis is given to symmetry, diffraction methods and techniques of crystal-structure determination, and the physical and chemical properties of crystals. The data are accompanied by discussions of theory, practical explanations and examples, all of which are useful for teaching. Volume G deals with methods and tools for organizing, archiving and retrieving crystallographic data. The volume describes the Crystallographic Information File (CIF), the standard data exchange and archival file format used throughout crystallography. The volume is divided into five parts: Part 1 – An introduction to the development of CIF. Part 2 – Details concepts and specifications of the files and languages. Part 3 – Discusses general considerations when defining a CIF data item and the classification and use of data. Part 4 - Defines all the data names for the core and other dictionaries. Part 5 - Describes CIF applications, including general advice and considerations for programmers. The accompanying software includes the CIF dictionaries in machine-readable form and a collection of libraries and utility programs. Volume G is an essential guide for programmers and data managers handling crystal-structure information, and provides in-depth information vital for recording or using single-crystal or powder diffraction data in small-molecule, inorganic and biological macromolecular structure science. More information on the series can be found at: http://it.iucr.org

Author : H. Fuess,Theo Hahn,Hans Wondratschek,Ulrich Müller,U. Shmueli,A. Authier,V. Kopský,D. B. Litvin,M. G. Rossmann,E. Arnold,Sydney Hall,B. McMahon
Publisher : Wiley
Page : 0 pages
File Size : 40,8 Mb
Release : 2010-05-11
Category : Science
ISBN : 0470661631

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International Tables for Crystallography, 8 Volume Set updated June 2010 by H. Fuess,Theo Hahn,Hans Wondratschek,Ulrich Müller,U. Shmueli,A. Authier,V. Kopský,D. B. Litvin,M. G. Rossmann,E. Arnold,Sydney Hall,B. McMahon Pdf

International Tables for Crystallography is the definitive resource and reference work for crystallography and structural science. Each of the eight volumes in the series contains articles and tables of data relevant to crystallographic research and to applications of crystallographic methods in all sciences concerned with the structure and properties of materials. Emphasis is given to symmetry, diffraction methods and techniques of crystal-structure determination, and the physical and chemical properties of crystals. The data are accompanied by discussions of theory, practical explanations and examples, all of which are useful for teaching. International Tables for Crystallography comprises 6,000 pages including nearly 2,000 pages of symmetry tables which are vital for the analysis of crystal structures: Volume A: Space-group symmetry, 5e Volume A1: Symmetry relations between space groups, 2e Volume B: Reciprocal space, 3e Volume C: Mathematical, physical and chemical tables, 3e Volume D: Physical properties of crystals Volume E: Subperiodic groups, 2e Volume F: Crystallography of biological macromolecules Volume G: Definition and exchange of crystallographic data This edition includes new editions of Volumes A1 and E, making International Tables the most up-to-date, dynamic, and comprehensive reference work available to crystallographers, and to all those who use crystallography across a wide range of fields.

Author : Eddy Arnold,Daniel M. Himmel,Michael G. Rossmann
Publisher : Wiley
Page : 916 pages
File Size : 51,6 Mb
Release : 2012-03-05
Category : Science
ISBN : 0470660783

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International Tables for Crystallography, International Tables for Crystallography by Eddy Arnold,Daniel M. Himmel,Michael G. Rossmann Pdf

International Tables for Crystallography Volume F is an expert guide to macromolecular crystallography for the structural biologist. It was commissioned by the International Union of Crystallography in recognition of the extraordinary contributions that knowledge of macromolecular structure has made, and will make, to the analysis of biological systems, from enzyme catalysis to the workings of a whole cell. The volume covers all stages of a crystallographic analysis from the preparation of recombinant proteins, through crystallization, diffraction data collection, phase determination, structure validation and structure analysis. Although the volume is written for experienced scientists, it is recognized that the reader is more likely to be a biologist interested in structure than a classical crystallographer interested in biology. Thus, there are chapters on the fundamentals, history and current perspectives of macromolecular crystallography, as well as on useful programs and databases such as the Protein Data Bank. Each chapter is written by one or more internationally recognized experts. This second edition features 19 new articles and many articles from the first edition have been revised. The new articles cover topics such as standard definitions for quality indicators, expression of membrane proteins, protein engineering, high-throughput crystallography, radiation damage, merohedral twinning, low-resolution ab initio phasing, robotic crystal loading, whole-cell X-ray diffraction imaging and halogen interactions in biological crystal structures. There are also new articles on relevant software, including software for electron microscopy. These enhancements will ensure that Volume F continues to be a key reference for macromolecular crystallographers and structural biologists. More information on the series can be found at: http://it.iucr.org

Author : Sydney R. Hall,Brian McMahon
Publisher : Springer Science & Business Media
Page : 609 pages
File Size : 49,5 Mb
Release : 2005-08-19
Category : Computers
ISBN : 9781402031380

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International Tables for Crystallography, Definition and Exchange of Crystallographic Data by Sydney R. Hall,Brian McMahon Pdf

International Tables for Crystallography Volume G, Definition and exchange of crystallographic data, describes the standard data exchange and archival file format (the Crystallographic Information File, or CIF) used throughout crystallography. It provides in-depth information vital for small-molecule, inorganic and macromolecular crystallographers, mineralogists, chemists, materials scientists, solid-state physicists and others who wish to record or use the results of a single-crystal or powder diffraction experiment. The volume also provides the detailed data ontology necessary for programmers and database managers to design interoperable computer applications. The accompanying CD-ROM contains the CIF dictionaries in machine-readable form and a collection of libraries and utility programs. This volume is an essential guide and reference for programmers of crystallographic software, data managers handling crystal-structure information and practising crystallographers who need to use CIF.

Author : Theo Hahn
Publisher : Wiley
Page : 932 pages
File Size : 43,7 Mb
Release : 2005-06-06
Category : Science
ISBN : 0470689080

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International Tables for Crystallography, Space-Group Symmetry by Theo Hahn Pdf

International Tables for Crystallography is the definitive resource and reference work for crystallography and structural science. Each of the eight volumes in the series contains articles and tables of data relevant to crystallographic research and to applications of crystallographic methods in all sciences concerned with the structure and properties of materials. Emphasis is given to symmetry, diffraction methods and techniques of crystal-structure determination, and the physical and chemical properties of crystals. The data are accompanied by discussions of theory, practical explanations and examples, all of which are useful for teaching. Volume A treats crystallographic symmetry in direct or physical space. It contains extensive tabulations and illustrations of the 17 plane groups, the 230 space groups and the 32 crystallographic point groups. Parts 1-5 of the volume present introductory material, including lists of symbols and terms, a guide to the use of the space-group tables, and the determination of space groups. Later parts discuss aspects of symmetry theory, such as crystal lattices and normalizers of space groups. Thoroughly updated and improved, the latest edition of Volume A includes an additional chapter on further properties of lattices.

Author : E. Prince
Publisher : John Wiley & Sons
Page : 1043 pages
File Size : 40,8 Mb
Release : 2004-01-16
Category : Science
ISBN : 9780470710296

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International Tables for Crystallography, Mathematical, Physical and Chemical Tables by E. Prince Pdf

International Tables for Crystallography is the definitive resource and reference work for crystallography and structural science. Each of the volumes in the series contains articles and tables of data relevant to crystallographic research and to applications of crystallographic methods in all sciences concerned with the structure and properties of materials. Emphasis is given to symmetry, diffraction methods and techniques of crystal-structure determination, and the physical and chemical properties of crystals. The data are accompanied by discussions of theory, practical explanations and examples, all of which are useful for teaching. Volume C provides the mathematical, physical and chemical information needed for experimental studies in structural crystallography. This volume covers all aspects of experimental techniques, using all three principal radiation types (X-ray, electron and neutron), from the selection and mounting of crystals and production of radiation, through data collection and analysis, to interpretation of results. Each chapter is supported by a substantial collection of references, and the volume ends with a section on precautions against radiation injury. Eleven chapters have been revised, corrected or updated for the third edition of Volume C. More information on the series can be found at: http://it.iucr.org

Author : Mois I. Aroyo
Publisher : Wiley
Page : 0 pages
File Size : 50,7 Mb
Release : 2017-02-13
Category : Science
ISBN : 0470974230

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International Tables for Crystallography, Space-group Symmetry by Mois I. Aroyo Pdf

International Tables for Crystallography is the definitive resource and reference work for crystallography and structural science. Volume A of the series, Space-group symmetry, contains diagrams and tables of data for the 17 plane groups, the 230 space groups and the 32 crystallographic point groups.This new edition is edited by M. I. Aroyo and has been extensively updated and revised. Part 1 of the volume provides an introduction to space-group symmetry. It includes chapters on groups, crystallographic and space-group symmetry, descriptions of space groups, coordinate-system transformations and methods of space-group determination. The final chapter provides a useful introduction to topics treated in more depth in Volumes A1 and E of the series. The chapters in this part have been written with teaching in mind, and will prove invaluable for undergraduates or graduates wishing to learn about symmetry in crystallography, while providing a clear introduction to the topic for researchers from other disciplines. Part 2 of the volume presents the diagrams and tables of plane- and space-group data. The layout of the tables of data, the symbols used in the diagrams and the classification of the space groups are explained in a useful guide. Together these form an essential resource not only for professional crystallographers, but also for chemists, physicists, mineralogists, biologists and material scientists who employ crystallographic methods and who are concerned with the structure and the properties of crystalline materials. Part 3 treats more advanced topics on space-group symmetry, and covers crystal lattices, point groups and crystal classes, space-group symbols and their use, lattice complexes, normalizers of space groups, and magnetic subperiodic groups and magnetic space groups. There are eight new chapters in this 6th edition of Volume A, and five chapters have been revised. The layout of the space-group tables has been simplified as the sub- and supergroup data are now available in Volume A1, and there are new general-position diagrams for the cubic space groups. Additional diagrams showing tilted, perspective views of some of the more complex cubic space groups are also provided. More information on the series can be found at: http://it.iucr.org