Chemistry 154A/254A


Bibliography


Introductory Texts

 

There are many books that present the topics of the course in a different way, at a different level or in a different context. It may help in understanding the material to consult some of these.

 

Abraham, R. J., Fisher, J., and Loftus, P., "Introduction to NMR Spectroscopy", Chichester, Wiley, 1988.

E. D. Becker, “High-resolution NMR. Theory and Chemical Applications”, Academic, San Diego, 2000.

Bovey, F. A., "Nuclear magnetic resonance spectroscopy", Academic, San Diego, 1988.

Breitmaier, E. “Structure Elucidation by NMR in Organic Chemistry”, Wiley, New York, 2002.

Breitmaier, E., and Voelter, W., "Carbon-13 NMR Spectroscopy. High-resolution methods and applications in organic chemistry and biochemistry", 3rd ed., VCH Publishers, 1987.

Crews, P., Rodriguez, J., Jaspars, M., "Organic structure analysis", Oxford, Oxford, 1998.

Farrar, T. C., "Introduction to pulse NMR spectroscopy", Farragut Press, Madison, WI, 1989

Farrar, T. C., and Becker, E.D., "Pulse and Fourier transform NMR", Academic, New York 1971.

Gunther, H., "NMR spectroscopy : basic principles, concepts, and applications in

    chemistry", 2nd ed. , New York, Wiley, 1995.

Harris, R. K., "Nuclear magnetic resonance spectroscopy: a physicochemical view", Pitman,

Marshfield, Mass., 1983.

Hennel, J. W., and Klinowski, J., "Fundamentals of NMR", Essex, U.K., Longman, 1993.

Hore, P. J., "Nuclear magnetic resonance", Oxford, Oxford, 1995.

Kemp, W., "NMR in chemistry : a multinuclear introduction", London, Macmillan, 1986.

Kitamaru, R., "Nuclear magnetic resonance: principles and theory", Elsevier, New York, 1990.

Paudler, W. W., "Nuclear magnetic resonance: General concepts and applications", New York, Wiley, 1987.

Macomber, R. S., "A complete introduction to modern NMR spectroscopy", New York, Wiley, 1998.

Yoder, C. H., and Schaeffer, Jr., C. D., "Introduction to multinuclear NMR", Benjamin/ Cummings, Menlo Park, 1987.

 

More Advanced Texts

 

Abragam, A., "The principle of nuclear magnetism", Clarendon, Oxford, 1961.

Bax, A., "Two-dimensional nuclear magnetic resonance in liquids", Kluwer, Boston, 1982.

Beckman, N., "Carbon‑13 NMR spectroscopy of biological systems", San Diego, Academic Press, 1995.

Berliner, L. J., and Reuben, J. eds., "NMR of paramagnetic molecules", New York, Plenum, 1993.

Bigler, P., " NMR spectroscopy: processing strategies", Weinheim, VCH, 1997.

Brey, W. S., "Pulse methods in ID and 2D liquid-phase NMR", Academic, San Diego, 1988.

Callaghan, P. T., "Principles of nuclear magnetic resonance microscopy", Clarendon, New York, 1991.

Canet, D., "NMR concepts and methods", Chichester, Wiley, 1991.

Carrington, A., and McLachlan, A. D., "Introduction to magnetic resonance, with applications to chemistry and chemical physics", New York, Wiley, 1979.

Cavanagh, J., Fairbrother, W. J., Palmer III, A. G., and Skelton, N. J., "Protein NMR spectroscopy", Academic, San Diego, 1995.

Chandrakumar, N. and Subramanian, S., "Modem techniques in high-resolution FT-NMR", Springer-Verlag, New York, 1987.

Clore, G. M., and Gronenborn, A. M., eds, "NMR of proteins", Boca Raton, CRC Press, 1993.

Cohen, S. M., "Physiological NMR spectroscopy: from isolated cells to man", New York Academy of Sciences, Vol. 508, New York, 1987.

Cowan, B., "NMR and relaxation", Cambridge, Cambridge, 1997.

Croasmun, W. R., Carlson, R. M. K., eds, "Two‑dimensional NMR spectroscopy: applications for chemists and biochemists"  2nd ed., New York, VCH, 1994.

Delpuech, J. J., "Dynamics of solutions and fluid mixtures by NMR", Chichester; New York, Wiley, 1995.

Derome, A., "Modern NMR techniques for chemistry research", Pergamon, New York, 1987. (An excellent investment for serious NMR spectroscopists.)

Emsley, J. W., Feeney, J., and Sutcliffe, L. H., "High resolution nuclear magnetic resonance spectroscopy", Pergamon, New York, 1965; 1966.

Ernst, R. R., Bodenhausen, G., and Wokaun, A., "Principles of nuclear magnetic resonance in on and two dimensions", Clarendon, Oxford, 1987; "the Bible".

Farrar, T. C. and Harriman, J. E., "Density matrix theory and its applications in NMR spectroscopy: an introduction to the theory and applications" Madison, WI : Farragut Press, 1995.

Freeman, R., "A handbook of nuclear magnetic resonance", Wiley, New York, 1987.

Freeman, R., "Spin choreography: basic steps in high resolution NMR", Oxford, Oxford, 1997.

Friebolin, H., "Basic one‑ and two‑dimensional NMR spectroscopy"  3rd ed. , VCH, New York, 1993.

Fukushima, E., and Roeder, S. B. W., "Experimental pulse: a nuts and bolts approach", Addison-Wesley, Reading, Mass., 1981; dated, but still much useful information.

Fyfe, C. A., "Solid state NMR for chemists", C.F.C. Press, Guelph, Ontario, 1983.

Gerstein, B. C., and Dybowski, C. R., "Transient techniques in NMR of solids, an introduction to theory and practice", Academic, Orlando, Fla., 1985.

Goldman, M., "Quantum description of high-resolution NMR in Liquids", Clarendon, Oxford, 1988.

Harris, R. K., and Mann, B. E., "NMR and the periodic table", Academic, New York, 1978.

Homans, S. W., "A dictionary of concepts in NMR", 2nd ed., Clarendon, Oxford, 1992.

Hore, P. J., Jones, J. A., Wimperis, S. “NMR: The toolkit”, Oxford, Oxford (2000).

Kaplan, J. I., and Fraenkel, G., "NMR in chemically exchanging systems", New York, Academic, 1980.

Kasler, F., "Quantitative analysis by NMR spectroscopy", New York, Academic, 1990.

Levy, G. C., and Lichter, R. L., "Nitrogen-15 nuclear magnetic resonance spectroscopy", Wiley, New York, 1979.

Levitt, M. H. “Spin Dynamics”, Wiley, New York, 2001.

Marshall, A. G., and Verdun, F. R., "Fourier transforms in NMR, optical, and mass spectrometry: a user's handbook", Elsevier, New York, 1990.

Mason, J. (ed.), "Multinuclear NMR", Plenum, New York, 1987.

McConnell, J., "The theory of NMR relaxation in liquids", Cambridge, New York, 1987.

Mehring, M., "Principles of high-resolution NMR in solids", 2nd ed., New York, Springer-Verlag, 1983.

Morris, P. G., "Nuclear magnetic resonance imaging in medicine and biology", Clarendon Press, New York, 1986.

Munowitz, M., "Coherence and NMR", Wiley, New York (1988).

Neuhaus, D., and Williamson, M. P., "The nuclear Overhauser effect in structural and conformational analysis", 2nd ed.,VCH Publishers, New York, 2000.

Noggle, J. H., and Schirmer, R. E., "The nuclear Overhauser effect", Academic, New York, 1971; dated, still useful.

Roberts, J. D., "An introduction to the analysis of spin-spin splitting in high-resolution nuclear magnetic resonance spectra", New York, Benjamin, 1961.

Roberts, J. D., “ABCs of FT-NMR”, University Science Books, Saucilito, 1990.

Sanders, J. K. M., and Hunter, B. K., "Modern NMR spectroscopy", Oxford, New York, 1987.

Sandstrom, J., "Dynamic NMR spectroscopy", New York, Academic, 1982.

Schraml, J., and Bellama, J. M., "Two-dimensional NMR spectroscopy", Wiley, New York, 1988.

Shaw, D., "Fourier transform NMR. spectroscopy", 2nd ed., New York, Elsevier, 1984. 

Slichter, C. P., "Principles of magnetic resonance" 2nd ed., New York, Springer-Verlag, 1978.

Steigel, A., and Spiess, H. W., "Dynamic NMR spectroscopy", New York, Springer-Verlag, 1978. [Series title: NMR, basic principles and progress, v. 15.]

Stejskal, E. O., Memory, J. D., "High resolution NMR in the solid state : fundamentals of CP/MAS", New York, Oxford, 1994.

Tossell, J. A., ed., "Nuclear magnetic shieldings and molecular structure", Boston, Kluwer, 1993.

 

Experimental Methods

 

Braun, S., Kalinowski, H.-O., Berger, S.,"150 and more basic NMR experiments: a practical course", New York, VCH, 1998.

Claridge, T. D. W. “High-Resolution NMR Techniques in Organic Chemistry”, Pergamon, Amsterdam, 1999.

Peterson, S. B., Muller, R. N., and Rinch, P. A., eds, "An introduction to biomedical NMR", G. Thieme Verlag, New York (1985). [This book gives a review of the basics of NMR and then focuses on imaging.]

Richards, S. A., "Laboratory guide to proton NMR spectroscopy", Blackwell, Oxford, New York, 1988.

Reid, D. G., ed., "Protein NMR techniques", Totowa, N.J., Humana, 1997.

Roberts, G. K. C. ed., "NMR of macromolecules: a practical approach", Oxford, New York, 1993.

 

Biological NMR Texts

 

Barbotin, J.-N., Portais, J.-C., Eds., “NMR in microbiology: theory and applications”,  Horizon, New York (2000).

Beckman, N. Carbon-13 NMR Spectroscopy of Biological Systems, Academic, San Diego, 1995.

De Certaines, J. D., Bovee, W. M. M. J., and Podo, F., Magnetic Resonance in Biology and Medicine, Pergamon, New York, 1992.

Evans, J. N. S. Biomolecular NMR Spectroscopy Oxford , New York , 1995.

Cavanagh, J., Fairbrother, W. J., Palmer III, A. G., and Skelton, N. J., Protein NMR Spectroscopy, Academic, San Diego, 1995. (An excellent investment for serious NMR spectroscopists.)

Gadian, D. G. “NMR and its applications to living systems”, 2nd Ed., Oxford, Oxford (1996).

Gillies, R. J., NMR in Physiology and Biomedicine,  San Diego, Academic, 1994.

Glore, G. M., and Gronenborn, A. M., "NMR of proteins", CRC Press, Boca Raton, 1993.

Hausser, K. H., and Kalbitzer, H. R., "NMR in medicine and biology: structure determination, tomography, in vivo spectroscopy", Springer-Verlag, New York, 1991.

Holzgrabe, U., Wawer, I., Diehl, B., "NMR spectroscopy in drug development and analysis"  New York, Wiley-VCH, 1999.

Ioannidou, C., "NMR of biological macromolecules", New York, Springer‑Verlag, 1994.

Krishna, N. R., Berliner, L. J., Eds., “Modern techniques in protein NMR”, Kluwer Academic/Plenum (1998) [Biological Magnetic Resonance Vol 16.]

Molema, R., Kubinyi, H., Folkers, G., Zerbe, O. “BioNMR in Drug Research”, Wiley (to be published October, 2002).

Wuthrich, K., "NMR in biological research: peptides and proteins", New York, American Elsevier, 1976.

 

Methods in Enzymology 176 and 177 (1989) have many useful articles on deuteration and other isotope labeling methods, sample preparation, assignment methods, distance geometry, molecular dynamics simulations, phosphorus NMR, ligand binding, exchange effects, in vivo enzyme activity measurements, multiple quantum methods, TOCSY, ROESY, NOESY, COSY.

 

Chemical Shifts

 

Heller, J.; Laws, D. D.; Tomaselli, M.; King, D.S.; "Determination of dihedral angles in peptides through experimental and theoretical studies of alpha-carbon chemical shielding tensors" J. Am. Chem. Soc. 119, 7827-7831 (1997).

Pearson, J. G.; Le, H.B.; Sanders, L.K.; Godbout, N. "Predicting chemical shifts in proteins: structure refinement of valine residues by using ab initio and empirical geometry optimizations" J. Am. Chem. Soc. 49, 11941-11950 (1997),

Pearson, J. G.; Wang, J. F.; Markley, J. K.; Le, H. B. "Protein structure refinement using carbon-13 NMR spectroscopic chemical shifts And quantum chemistry" J. Am. Chem. Soc. 117, 8823-8829 (1995).

Sitkoff, D.; Case, D. A. "Theories of chemical shift anisotropies in proteins and nucleic acids", Prog. NMR Spectrosc. 32, 165-190 (1998).

Wishart, D. S.; Sykes, B. D.; Richards, F. M. (1991) "Relationship between NMR chemical shift and protein secondary structure", J. Mol. Biol. 222, 311-333 (1991).

Wishart, D. S.; Watson, M. S.; Boyko, R. F.; Sykes, B. D. "Automated 1H and 13C chemical shift prediction using the BioMagResBank " J. Biomol. NMR 10, 329-336 (1997).

Wishart, D.S.; Nip, A.M. "Protein chemical shift analysis: a practical guide" Biochem. Cell Biol., 76, 153-173 (1998).

 


Primary Literature

 

The following are typical places where literature on biological applications of NMR spectroscopy appears.

 

Journals

Biochemistry

Concepts in Magnetic Resonance

Journal of Magnetic Resonance

Journal of Magnetic Resonance Series B (The journal was once divided into two “Series”.)

Journal of Biomolecular NMR

Journal of Protein Science

Magnetic Resonance in Medicine

NMR in Biomedicine

Physiological Chemistry and Physics and Medical NMR

Protein Science

 

Review Series

Ann. Rev. Biophys. Biomol. Struct.

Annual Reports on NMR Spectroscopy, Academic

Biological Magnetic Resonance, Plenum

Current Opinion in Structural Biology

Magnetic Resonance in Biology, Wiley

Progress in Biophysics and Biomolecular Structure, Pergamon

Progress in NMR Spectroscopy, Pergamon

Advances in Magnetic Resonance in Food Scienc

 

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