Preface / S. Szymanski |
Proton Tunnelling |
Effects in Metal Hydride NMR / N. Asakawa ; T. Kameda ; S. Kuroki ; H. Kurosu ; S. Ando ; I. Ando ; A. Shoji |
Structural Studies of Hydrogen-Bonded Peptides and Polypeptides by Solid State NMR / W.S. Price |
NMR Imaging / J. Grandjean |
NMR Studies of Interfacial Phenomena |
Subject Index |
(Chapter Headings) Application of NMR Spectroscopy to Sciences and Technologies of Glasses and Ceramics / C. Faber ; W.P. Power |
Applications of NMR to Food Science |
Application of 207PB NMR Parameters / Keith Orrell ; J.C. Lindon |
High-Resolution Solid State NMR Studies on Ceramics / 1: |
Gradient NMR |
Dynamic aspects of membrane proteins and membrane-associated |
In vivo Proton NMR Studies in Skeletal Musculature |
Applications of Heteronuclear X,Y-Correlation |
Applications of 29 Si NMR Parameters |
Advances in Probe Design for Protein NMR |
Resolution enhancement in in vivo NMR spectroscopy / P.D. Ellis |
NMR Studies of Zeolites / R.E. Wasylishen |
Pharmaceutical Applications of NMR |
Dynamic NMR Spectroscopy Inorganic and Organometallic Chemistry |
Peptides as revealed by 13C NMR: lessons from bacteriorhodopsin as an intact protein / J.K. Nicholson |
Quality Assessment of Horticultural Products by NMR |
Spectroscopy in Organometallic and Organoelement Chemistry |
NMR Studies of Higher-Order Structures of Solid Polymers / F. Stallmach2: |
Nuclear Magnetic Resonance Spectroscopy in Forensic Science |
Applications of NMR to food science / A. M. Gil |
Applications of NMR to Thermostable Proteins |
Applications of NMR in Solid-Phase Synthesis |
NMR Studies of b-type Haemoproteins Reconstituted with a Ring-Fluorinated Haem |
Diffusion in Soft Polymer Systems as Approached by Field Gradient NMR |
Organic Thin Films / A.S. Lipton ; R.G. Kidd |
NMR of persistent carbocations from ploycyclic aromatice hydrocarbons(PAHS) / J.R. Everett |
High Pressure NMR Studies on Lyotropic Lipid Mesophases and Model Biomembranes |
Advances in Theoretical and Physical Aspects of Spin-Spin Couplings |
Diffusion in a closed sphere / P. Galvosas ; C. Pascoal Neto3: |
A Study of Conformational Stability of Polypeptide Blends by Solid State NMR Spectroscopy |
Site Directed Solid State NMR on Membrane Proteins |
How Far Can the Sensitivity of NMR be Increased? |
Low Temperature Solid-State NMR Spectroscopy. A Strategy for the Direct Observation of Quadrupolar Nuclides of Biological Interest |
NMR Studies of Isolated Spin Pairs in the Solid State |
NMR Spectroscopy of Biofluids |
Automatic Analysis of NMR Spectra |
Spin echo NMR direg;usion studies / 4: |
Solid State NMR Studies of Wood and other Ligno-Cellulose Materials / B.E. Mann |
High Pressure NMR Studies in Proteins / J.F. Hinton |
Applications of Low-Field NMR to Food Science |
The Oxidation-State Dependence of Transition-Metal Shieldings / D.A. Middleton ; L.B. Krivdin ; Brian J. Goodfellow5: |
NMR Studies of Ion Transporting Biological Channels |
Xenon NMR Spectroscopy |
Residual Dipolar Couplings: Measurements and Applications to Biomolecular Studies |
NMR methods for Characterising ligand-receptor and drug-membrane interactions in pharmaceutical research |
Recent advances in theoretical calculations of indirect spin-spin coupling constants / R.H. Contreras ; Anjos L. Macedo ; D. Gudat ; L. Ernst |
NMR Structural Studies of Iron-Sulpher Proteins / G. Binsch |
Applications of Heteronuclear X,Y--Correlation Spectroscopy in Organometallic and Organoelement Chemistry |
Recent Advances in NMR Studies of Cyclophanes / Qun Chen ; Ana Ramos ; B. Wrackmeyer |
The Cinderella Nuclei |
Application of 119Sn NMR Parameters / Hiromichi Kurosu ; J. Kowalewski ; Helena Santos |
Solid-state NMR studies on semicrystalline polymers / A. Iuga et al. ; J. Malito |
Permutation Symmetry in NMR Relaxation and Exchange |
NMR Studies of Wine Chemistry and Wine Bacteria |
Applications of solid-state 31P NMR spectroscopy |
Nuclear Spin Relaxation in Diamagnetic Fields / J. Farjon et al. |
Copper-63 NMR Spectroscopy / Claudio Dalvit |
Selective NMR excitations in chiral analysis / S.L GragePart 2: |
Water Signal Supression in NMR Spectroscopy / W. Meiler ; J. M. Boehlen |
Proton Phase Sensitive Pulsed-Field-Gradient Double-Quantum NMR Spectroscopy / A. Watts ; R. Meusinger, NMR of Coals and Coal Products |
Applications of REDOR for Distance Measurements in Biological Solids / T. Baba |
Organic Systems and Solutions of Macromolecules and Aggregates |
Index. / Y. Ono |
Variable Temperature 1H MAS NMR: A Powerful Tool for the Investigation of Dynamic Properties of Acidic Protons in Zeolites and Heteropoly Compounds |
List of Contributors |
Long-Range [superscript 1]H-[superscript 15]N Heteronuclear Shift Correlation / Gary E. Martin ; Antony J. Williams |
Introduction |
New Long-Range Heteronuclear Shift Correlation Methods |
NMR Probe Technology Developments |
Computer-Assisted Structure Elucidation Using [superscript 15]N Chemical Shift and [superscript 1]H-[superscript 15]N Long-Range Correlation Information |
Long-Range Correlation Studies Involving [superscript 15]N |
Conclusions / 6: |
References |
Magic-Angle-Spinning Solid-State NMR Applied to Polypeptides and Proteins / Colan E. Hughes ; Marc Baldus |
Methods |
Applications |
Acknowledgements |
NMR Studies of Dynamic Processes in Organic Solids / D. Reichert |
Experimental Methods |
Applications of Dynamic Solid-State NMR in Organic Solids |
NMR Studies of Nanoparticles / Christian Mayer |
Nuclear Magnetic Resonance Techniques |
Numerical Simulation Procedure |
General Applications and Examples |
Conclusion |
Microscopy in Magnetic Resonance Imaging / P.T. Narasimhan ; Russell E. Jacobs |
Signal and Noise in Magnetic Resonance Imaging |
Contrast |
Imaging Methods, Pulse Sequences, and the Point Spread Function |
Other Imaging Methods |
Prospects for Higher Resolution / 7: |
Applications of Optical Pumping and Polarization Techniques in NMR: I. Optical Nuclear Polarization in Molecular Crystals / Boyd M. Goodson |
Multiple Quantum NMR of Partially Aligned Molecules / Leslie D. Field |
NMR of partially aligned molecules |
Multiple quantum NMR and spectral simplification |
Excitation and detection of multiple quantum coherence |
Selective deuteration to simplify spectral analysis |
The analysis and simulation of multiple quantum spectra |
Heteronuclear MQNMR |
Measuring diffusion in anisotropic media using MQNMR / 8: |
Multiple quantum spectra of exchanging systems / 9: |
MQ relaxation in anisotropic media / 10: |
Counting spins in clusters / 11: |
Studies of aligned molecules by MQNMR / 12: |
Solid-State NMR Studies of Molecular Motion / Melinda J. Duer |
Lineshape analysis and measurement of motionally averaged interactions |
Relaxation time measurements |
Exchange experiments |
NMR Studies of Phase Transitions / C. Odin |
Phase Transitions and NMR: Generalities and Static Contribution |
Phase Transitions and NMR: Motions |
Ferroelectric Phase Transitions, H-Bonded Systems |
Coexistence, Hysteresis and Kinetics |
Single-Crystal Phase Transition Studies |
Miscellaneous Phase Transitions |
Conclusion and Perspectives |
Acknowledgment |
Application of Multi-Way Analysis to 2D NMR Data / Henrik T. Pedersen ; Marianne Dyrby ; Soren B. Engelsen ; Rasmus Bro |
General theory |
Analysis of 2D and 3D NMR data |
High-Resolution Protein Structure Determination by NMR / Hiroyuki Takashima |
Statistics of protein structures solved by NMR on protein data bank |
Critical factors for NMR structure qualities |
High-performance computing |
NMR structure determination process overview |
Structure calculation |
High-performance computing implementation for structure determination |
Basic NMR-derived constraints for structure calculations |
Improve target function quality |
Dynamics |
Quality check of the NMR ensemble |
Protein sample preparations |
NMR Experiments / 13: |
Concluding remarks / 14: |
Acknowledgments |
Index |
Applications of NMR Spectroscopy to the Structure and Ionic Aggregates of Ionomers |
Applications of NMR Techniques to Coal Science |
An NMR study of strongly correlated superconductors |
NMR in Context / P.S. Belton |
Magnetic Resonance Imaging / M.J. McCarthy ; M.K. Cheung |
Magnetic Resonance Microscopy / X. Zhou ; T.L. Peck ; J.B. Litchfield |
Stable IsotopeAnalysis of Food and Beverages by Nuclear Magnetic Resonance / G.J. Martin ; M.L. Martin |
On-line Applications in Food Science / C. Tellier ; F. Mariette |
The Use of ESR Spectroscopy for the Identification of Irradiated Food / M.H. Stevenson ; R. Gray |
Wide-line and High-resolution in 1H NMR of Food Materials / T.M. Eads |
Conformational Characterization of Polysaccharides as Studied by High-resolution 13C Solid-state NMR / H. Saito |
Studies of Protein Structure by NMR Spectroscopy / G.M. Smith |
NMR of Lipids / F.D. Gunstone ; V.K.S. Shukla |
Probing Water Relations in Food Using Magnetic Resonance Techniques / X. Sun ; S.J. Schmidt |
Milk / N.M. Wahlgren ; T. Drakenberg |
NMR Studies in Meat / J.-P. Renou |
Applications of NMR to Drying / J.E. Maneval |
Chapter References |
Contributors |
Magnetic Resonance of Systems with Equivalent Spin-1/2 Nuclides / John A. Weil |
Preamble |
Exchange Actions and Interactions |
Equivalent Nuclides Within a Molecular Species |
The Effects of Motions |
Exchange Degeneracy |
Spin-Spin Interactions of Sets of Distinct Particles |
Selected Molecules with Equivalences |
Spin-Hamiltonian Parameters |
Spectral Degeneracy |
Acknowledgement |
Protein Dynamics as Reported by NMR / Zoltán Gáspári ; András Perczel |
Motions and Time Scales in Proteins |
Representation of Protein Structure and Dynamics |
Exploring Protein Structure and Dynamics: A Brief Overview of Techniques |
NMR Spectroscopy for Determining Protein Structure and Dynamics |
Examples Highlighting the Role of Protein Internal Dynamics in Biological Processes |
Concluding Remarks |
Virtual MRS: Spectral Simulation and its Applications / Brian J. Soher ; Karl Young ; Lana Kaiser |
Introduction and Background |
From Physics to Object-Oriented Programming |
Practical Applications and Implications |
Simulation of Molecular Motion of Quadrupolar Nuclei in Solid-State NMR Spectra / Flemming H. Larsen |
Theory |
Numerical Simulations |
Results and Discussion |
NMR Studies of Disorder in Condensed Matter Systems / K. P. Ramesh |
Dipolar Glasses / l: |
NMR Study of Relaxor Ferroelectrics |
Conducting polymers |
Recent Advances in HMBC Studies / J. Furrer |
Open Core NMR / K. Takeda |
Nuclear spin relaxation for structural and stereochemical determinations in small or medium sized molecules / D.Canet |
NMR studies on structurally or dynamically heterogeneous systems: dynamic aspects of hydrogels, protein fibrils and membrane proteins / M. Saito |
NMR Studies of optically active Schiff bases / Z. Rozwadowski |
Probing interactions between small molecules and polymers by means of NMR spectroscopy / M. Valentini |
Structure and Membrane Interactions of Antimicrobial Peptides as Viewed by Solid-State NMR Spectroscopy / Marise Ouellet ; Michele Auger |
Study of Antimicrobial Peptides in Membranes |
Effects of Antimicrobial Peptides on Model Lipid Membranes |
Chemical Exchange / Alex D. Bain |
Overview, Trends and Opinions |
Methodology |
Conclusions and Acknowledgments |
Rhodium-103 NMR / Laurence Carlton |
Acquisition of Data |
Calibration of Spectra |
Factors Underlying the Chemical Shift |
Influence of Temperature on the Chemical Shift |
Influence of Solvent on the Chemical Shift |
Other Influences on the Chemical Shift |
Correlation of [delta]([superscript 103]Rh) with Chemical and Structural Parameters |
Parahydrogen-Induced Polarisation (PHIP) |
High-Pressure Studies |
Solid-State Studies |
Clusters |
Calculated Chemical Shifts |
Spin Coupling Constants |
Relaxation Times / 15: |
Abbreviations / 16: |
Layout of Tables / Appendix: |
The Indirect Detection of Metal Nuclei by Correlation Spectroscopy (HSQC and HMQC) / Jonathan A. Iggo ; Jianke Liu ; Gillian Overend |
2D NMR Spectroscopy |
Spin Systems |
Review of Recent Reports of the Indirect Detection of Metal Nuclei |
Theoretical and Experimental Studies on 19F NMR Shieldings in Mineral Glasses, Zeolites and Related Silsequioxanes / J.A. TossellChapter 1: |
NOE Studies of Solvent-Solute Interactions / J.T. GerigChapter 2: |
DFT Computations of Transition Metal Chemical Shifts / Michael Buehl ; Muelheim an der RuhrChapter 3: |
Solid-State NMR Studies of Collagen Structure and Dynamics in Isolated Fibrils and in Biological Tissues / Daniel Huster ; Halle-WittembergChapter 4: |
NMR Studies of Beverage / J. Kidric ; LjubljanaChapter 5: |
Contribution of NMR Spectroscopy to Flavour Release and Perception / L. Tavel ; E. Guichard ; C. Moreau ; DijonChapter 6: |
Polymer Blend Miscibility / Jeffrey L. WhiteChapter 7: |
Quantitative 2D NMR Studies / Harri Koskela |
Concepts |
Recent Advances in Solvent Suppression for Solution NMR: A Practical Reference / Ryan T. Mckay |
Rationale |
Solvent Suppression |
Suppression Pulse Sequences |
Comparisons, Conclusions, and Advice |
Photo-CIDNP Spectroscopy / Martin Goez |
CIDNP Phenomena |
CIDNP Theory |
Instrumentation and Techniques |
Chemical Information Obtainable by High-Field CIDNP |
Recent Applications of CIDNP to Chemical and Biochemical Problems |
Techniques Used for 14N NQR Studies / V. Mikhaltsevitch |
Short-repetition Time Sequences in NQR of Nitrogen |
Polarization Enhancement of NQR Signals |
Multi-pulse Sequences Under Conditions of Magneto-acoustic and Piezo-Electric Ringing |
Chlorine, Bromine, and Iodine Solid-State NMR Spectroscopy / Cory M. Widdifield ; Rebecca P. Chapman ; David L. Bryce |
Theoretical Background |
Experimental and Computational Methods |
Survey of Available Experimental Data |
Relativistic Computations of NMR Parameters from First Principles. Theory and Applications' / J.Autschbach ; S.Zheng |
Applications of Silicon-Carbon Coupling Constants / V.Blechta |
One Dimensional Double Quantum Filter NMR Studies / N.Chandrakumar |
Analysis of Proton NMR Spectra of Strongly and Weakly Dipolar Coupled Spins: Special Emphasis on Spectral Simplification, Chiral Discrimination and Discerning of Degenerate Transitions / B.BaisHya(1) ; U.R.Prabhu (1,2) ; N.Suryaprakash (1) |
Applications of 33S NMR Spectroscopy / Roberta Musio |
NMR Spectroscopic Properties of Sulphur-33 |
33S NMR Parameters |
33S NMR Parameters and Molecular Structure |
Theoretical Calculations of 33S NMR Parameters |
Appendix |
NMR of Peptide Toxins / K. Johan Rosengren ; Norelle L. Daly ; David J. Craik |
NMR as a Tool for Determining the Structures of Toxins |
Microbial Toxins |
Plant Toxins |
Animal Toxins |
Conclusions and Outlook |
Application of NMR Spectroscopy in Isotope Effects Studies / Stefan Jankowski |
Isotope Effects on Chemical Shifts and Spin-Spin Coupling Constants |
Kinetic Isotope Effects Measured at Natural Abundance |
Kinetic Isotope Effect Studies of Reaction Mechanisms by NMR Spectroscopy |
Residual Dipolar Couplings for the Configurational and Conformational Analysis of Organic Molecules / G. Kummerlöwe ; B. Luy |
Alignment Media for Weak Alignment |
Scaling of Alignment |
Pulse Sequences |
Conclusion and Outlook |
See Color Plate Section at the end of this book |
Recent Developments in Liquid-State Inadequate Studies / Dušan Uhrír |
Inadequate-The Basic Concept |
Increasing the Sensitivity of Inadequate |
Measurement of 13C-13C Coupling Constants |
Applications of High-Resolution Inadequate to 13C |
Applications of Inadequate to Nuclei Other Than 13C |
Outlook |
Phosphorus-31 NMR Spectroscopy of Condensed Matter / Marek J. Potrzebowski ; Slawomir Kazmierski ; Hassan Kassassir ; Beata Miksa |
Progress in Methodology |
Applications of 31P SS NMR Spectroscopy |
Recent Applications of Solid-State 17O NMR / K. Yamada |
17O Synthesis |
Background of solid-State 17O NMR |
Fundamentals of 17O NMR in Biological Solids |
Applications of Solid-State 17O NMR in Biochemistry |
Spatial Inhomogeneity of Cavities in Polymer Network Systems as Characterised by Field-Gradient NMR Using Probe Diffusant Molecules and Polymers with Different Sizes / Kazuhiro Kamiguchi ; Shigeki Kuroki ; Yuji Yamane ; Mitsuru Satoh ; Isao Ando |
Network Structure of Polymer Gets and Diffusional Behaviour of probe polymers |
Network Structure of Micrometre-Scale Cavity Obtained from Phase-Separated Polymer Blends as Characterised by Using Probe Molecules |
Practical NMR Analysis of Morphology and Structure of Polymers / Takeshi Yamanobe ; Hiroki Uehara ; Masaki Kakiage |
Analysis Method of Free Induction Decay of 1H Pulse NMR for Polymers |
Morphology and Relaxation Behaviour |
Kinetics of Dynamic Process of Polymers |
Microporous Carbon Materials / K. V. Romanenko |
Mesoporous Carbon Materials |
NMR Studies for Mapping Structure and Dynamics of Nucleosides in Water / Bernard Ancian |
Nomenclature and Symbols |
About Stacking of Nucleosides in Water |
Structure in Water |
Dynamics in Water |
Time-Domain NMR Applied to Food Products / J. van Duynhoven ; A. Voda ; M. Witek ; H. Van As |
History |
Equipment |
One-Dimensional Relaxometry and Diffusometry |
Two-Dimensional NMR Diffusometry and Relaxometry |
Data-Analysis Approaches |
Benchtop Time-Domain NMR Applications |
Mobile Time-Domain NMR Applications |
Perspectives and Conclusions |
From Helical Jump to Chain Diffusion: Solid-State NMR Study of Chain Dynamics in Semi-Crystalline Polymers / Yefeng Yao |
NMR Strategies for Probing Chain Dynamics in Solid Polymeric Materials |
Helical Jump and Chain Diffusion in Semi-Crystalline Polymers |
Recent Developments in HMBC (Heteronuclear Multiple Bond Correlation) Experiments / Norbert Müller ; Wolfgang Schoefberger ; Judith Schlagnitweit |
Two Dimensional Higher Quantum Correlation and Resolved Techniques for the Analyses of Complex 1H NMR Spectra of Scalar Coupled Spins / N. Suryaprakash |
High Resolution Magic Angle Spinning | Enabling Applications of NMR Spectroscopy to Semi-Solid Phases / William P. Power |
Accurate measurement of small J couplings / Zhong Chen ; Yuqing Huang ; Yanqin Lin ; Shuhui Cai |
High-resolution 1H NMR spectroscopy of solids / Paul Hodgkinson |
Multiple-Wave-Vector Diffusion-Weighted NMR / J¿urgen Finsterbusch |
Constant Time REDOR NMR Spectroscopy / Thomas Echelmeyer ; Sebastian Wegner ; Leo van Wüllen |
Recent advances in solid-state 25Mg NMR spectroscopy / Jair C. C. Freitas ; Mark E. Smith |
Methods and Applications of Phosphorus NMR Spectroscopy in Vivo / Jing-Huei Lee ; Richard A. Komoroski ; Wen-Jang Chu ; Jonathan A. Dudley |
Compact superconducting magnet design for nuclear magnetic resonance: The minimum stored energy (MSE) approach / Quang M. Tieng ; Viktor Vegh |
Getting the Most Out of HSQC and HMBC Spectra / William F. Reynolds ; Darcy C. Burns |
A Review of REDCRAFT: Simultaneous Investigation of Structure and Dynamics of Proteins from RDC Restraints / Homayoun Valafar ; Mikhail Simin ; Stephanie Irausquin |
NMR Studies of Solid State Dynamics / Danuta Kruk ; Alexei Privalov ; Wojciech Medycki ; Cezary Uniszkiewicz ; Wlodzimierz Masierak ; Ryszard Jakubas |
Earth's Field Spectroscopy / Mark Hunter |
Recent Advances in Nuclear Shielding Calculations / Angel C. de Dios ; Cynthia J. Jameson |
Pure Phase Encode Magnetic Resonance Imaging of Fluids in Porous Media / Colleen E. Muir ; Bruce J. Balcom |
Steroids and NMR / Martin Jaeger ; Ruud L.E.G. Aspers |
Structural Characterization of Zeolites by Advanced Methods of Solid State NMR Spectroscopy / Luís Mafra ; José Alejandro Vidal-Moya ; Teresa Blasco |
Recent Progress in the Solid-State NMR Studies of Biomineralization / Tim W. T. Tsai ; Jerry C. C. Chan |
Recent advances in the NMR spectroscopy of chlorine, bromine and iodine / Bradley J. Butler ; James M. Hook ; Jason B. Harper |
Solution-State Dynamic Nuclear Polarization / Mark D. Lingwood ; Songi Han |
Solid-state NMR of membrane proteins: moving towards greater complexity / Lynmarie K. Thompson |
Chromatographic NMR / Stefano Caldarelli |
Kinetic Monte Carlo Simulation of DNMR Spectra / Zsófia Szalay ; János Rohonczy |
NMR Studies of Antimicrobial Peptides / H.J. Vogel ; E.F. Haney |
NMR Studies of Protein Folding Prof / M. Demura* ; M. Miguguchi ; K. Kauvans |
Applications of NOE in Molecular Biology Prof / M.P. Williamson |
Recent Applications of REDOR to Biological Problems Prof / T. Gullion |
Electrophoretic NMR-Ions, Molecules, Mixtures, Pores and Complexes / P. C. Griffiths |
Two Dimensional NMR on Biopsy and In Vivo / S. Ramadan ; C.E. Mountford |