Macromolecular crystallography /
副标题：无
作 者：edited by Charles W. Carter, Jr., Robert M. Sweet.
分类号：
ISBN：9780121822712
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简介
Summary:
Publisher Summary 1
Accurate molecular structures are vital for rational drug design and for structure-based functional studies directed toward the development of effective therapeutic agents and drugs. Crystallography can reliably predict structure, both in terms of folding and atomic details of bonding.
* Methodological methods in crystals
* Methodological methods data analysis
Publisher Summary 2
Accurate molecular structures are vital for rational drug design and for structure-based functional studies directed toward the development of effective therapeutic agents and drugs. Crystallography can reliably predict structure, both in terms of folding and atomic details of bonding.
* Methodological methods in crystals
* Methodological methods data analysis
目录
Phases: Horizon Methods H.A. Hauptman
Shake and Bake: An Algorithm for Automatic Solution ab Initio of Crystal Structures G. Bricogne
Ab Initio Macromolecular Phasing: A Blueprint for an Expert System Based on Structure Factor Statistics with Built-In Stereochemistry
Model-Independent Map Refinement F.M.D. Vellieux and R.J. Read
Noncrystallographic Symmetry Averaging in Phase Refinement and Extension K.Y.J. Zhang and K. Cowtan and P. Main
Combining Constraints for Electron Density Modification C.J. Gilmore and G. Bricogne
MICE Computer Program C.W. Carter and S. Xiany
Phase Improvement Using Conditional Probability Methods: Maximum Entropy Solvent Flattening with Phase Permutation R.J. Read
Model Phases: Probabilities and Bias
Models: Model Building S. Fortier and A. Chiverton and J. Glasgow and L. Leherte
Critical-Point Analysis in Protein Electron-Density Map Interpretation J.S.Sack and F.A. Quiocho
Chain: A Crystallographic Modeling Program T.A. Jones and M. Kjeldgaard
Electron Density Map Interpretation G.J. Kleywegt and T.A. Jones
Model Building and Refinement Practice B.C. Finsel
LORE: Exploiting Database of Known Structures
Refinement A.T. Branger and L.M. Rice
Crystallographic Refinement by Simulated Annealing: Methods and Applications V.S. Lamzin and K.S. Wilson
Automated Refinement for Protein Crystallography D.E. Tronrud
The TNT Refinement Package G.M. Sheldrick and T.R. Schneider
SHELXL: High-Resolution Refinement J. Badger and D.L. Caspar
Modeling and Refinement of Water Molecules and Disordered Solvent L.H. Jensen
Refinement and Reliability of Macromolecular Models Based on X-Ray Diffraction Data
Verification: Safe Crystallography A. T. Branger
Free R Value: A More Objective Statistic for Crystallography D. Eisenberg and R. Lathy and J.U. Bowie
VERIFY3D: Assessment of Protein Models with Three-Dimensional Profiles
Dynamic Properties: From Static Diffraction Data J.B. Clarage and G.N. Phillips, Jr.
Analysis of Diffuse Scattering and Relation to Molecular Motion
From Time-Resolved Studies: Laue Diffraction K. Moffat
Laue Diffraction I.J. Clifton and E.M.H. Duke and S. Wakatsuki and Z. Ren
Evaluation of Laue Diffraction Diagrams I. Schlichting and R.S. Goody
Triggering Methods in Crystallographic Enzyme Kinetics
Presentation and Analysis: Illustrating Structures M. Carson
Ribbons E.A. Merrit and D.J. Bacon
Raster3D: Photorealistic Molecular Graphics
Modeling Structures G.J. Kleywegt and T.A. Jones
Detecting Folding Motifs and Similarities in Protein Structures
Databases G.L. Gilliland
Biological Macromolecule Crystallization Database E.E. Abola and J.L. Sussman and J. Prilusky and N.O. Manning
Protein Data Bank Archives of Three-Dimensional Macromolecular Structures P.E. Bourne and H.M. Berman and J.D. Westbrook and B. McMahon and K.D. Watenpaugh and P.M.D. Fitzgerald
Macromolecular Crystallographic Information File
Program Packages W.F. Furey and S. Swaminathan
Phases-95: A Program Package forProcessing and Analyzing Diffraction Data from Macromolecules M. Winn and E.J. Dodson and A. Ralph
Collaborative Computational Project
Number 4: Providing Programs for Protein Crystallography
Author Index
Subject Index
Shake and Bake: An Algorithm for Automatic Solution ab Initio of Crystal Structures G. Bricogne
Ab Initio Macromolecular Phasing: A Blueprint for an Expert System Based on Structure Factor Statistics with Built-In Stereochemistry
Model-Independent Map Refinement F.M.D. Vellieux and R.J. Read
Noncrystallographic Symmetry Averaging in Phase Refinement and Extension K.Y.J. Zhang and K. Cowtan and P. Main
Combining Constraints for Electron Density Modification C.J. Gilmore and G. Bricogne
MICE Computer Program C.W. Carter and S. Xiany
Phase Improvement Using Conditional Probability Methods: Maximum Entropy Solvent Flattening with Phase Permutation R.J. Read
Model Phases: Probabilities and Bias
Models: Model Building S. Fortier and A. Chiverton and J. Glasgow and L. Leherte
Critical-Point Analysis in Protein Electron-Density Map Interpretation J.S.Sack and F.A. Quiocho
Chain: A Crystallographic Modeling Program T.A. Jones and M. Kjeldgaard
Electron Density Map Interpretation G.J. Kleywegt and T.A. Jones
Model Building and Refinement Practice B.C. Finsel
LORE: Exploiting Database of Known Structures
Refinement A.T. Branger and L.M. Rice
Crystallographic Refinement by Simulated Annealing: Methods and Applications V.S. Lamzin and K.S. Wilson
Automated Refinement for Protein Crystallography D.E. Tronrud
The TNT Refinement Package G.M. Sheldrick and T.R. Schneider
SHELXL: High-Resolution Refinement J. Badger and D.L. Caspar
Modeling and Refinement of Water Molecules and Disordered Solvent L.H. Jensen
Refinement and Reliability of Macromolecular Models Based on X-Ray Diffraction Data
Verification: Safe Crystallography A. T. Branger
Free R Value: A More Objective Statistic for Crystallography D. Eisenberg and R. Lathy and J.U. Bowie
VERIFY3D: Assessment of Protein Models with Three-Dimensional Profiles
Dynamic Properties: From Static Diffraction Data J.B. Clarage and G.N. Phillips, Jr.
Analysis of Diffuse Scattering and Relation to Molecular Motion
From Time-Resolved Studies: Laue Diffraction K. Moffat
Laue Diffraction I.J. Clifton and E.M.H. Duke and S. Wakatsuki and Z. Ren
Evaluation of Laue Diffraction Diagrams I. Schlichting and R.S. Goody
Triggering Methods in Crystallographic Enzyme Kinetics
Presentation and Analysis: Illustrating Structures M. Carson
Ribbons E.A. Merrit and D.J. Bacon
Raster3D: Photorealistic Molecular Graphics
Modeling Structures G.J. Kleywegt and T.A. Jones
Detecting Folding Motifs and Similarities in Protein Structures
Databases G.L. Gilliland
Biological Macromolecule Crystallization Database E.E. Abola and J.L. Sussman and J. Prilusky and N.O. Manning
Protein Data Bank Archives of Three-Dimensional Macromolecular Structures P.E. Bourne and H.M. Berman and J.D. Westbrook and B. McMahon and K.D. Watenpaugh and P.M.D. Fitzgerald
Macromolecular Crystallographic Information File
Program Packages W.F. Furey and S. Swaminathan
Phases-95: A Program Package forProcessing and Analyzing Diffraction Data from Macromolecules M. Winn and E.J. Dodson and A. Ralph
Collaborative Computational Project
Number 4: Providing Programs for Protein Crystallography
Author Index
Subject Index
Macromolecular crystallography /
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