Computational Aspects of the Study of Biological Macromolecules by Nuclear Magnetic Resonance Spectroscopy / Edition 1

Hardcover (Print)
Buy New
Buy New from
Used and New from Other Sellers
Used and New from Other Sellers
from $60.00
Usually ships in 1-2 business days
(Save 87%)
Other sellers (Hardcover)
  • All (6) from $60.00   
  • New (4) from $345.34   
  • Used (2) from $60.00   

Editorial Reviews

The scientific part of a workshop at Il Ciocco Italy, June 1990. Presents 37 papers on the use of computers in the NMR spectroscopic study of biological macromolecules. Among the topics are NMR before computers, applying the linear prediction principle, and such computer programs as STELLA, CLAIRE, and MARCO POLO. Annotation c. Book News, Inc., Portland, OR (
Read More Show Less

Product Details

  • ISBN-13: 9780306441141
  • Publisher: Springer US
  • Publication date: 10/25/2007
  • Series: Nato Science Series A: (closed) , #225
  • Edition description: 1993
  • Edition number: 1
  • Pages: 464
  • Product dimensions: 10.00 (w) x 7.00 (h) x 1.06 (d)

Table of Contents

1. Without Computers — No Modern NMR.- 2. Parametric Estimation in 1-D, 2-D, and 3-D NMR.- 3. Computational Aspects of Multinuclear NMR Spectroscopy of Proteins at NMRFAM.- 4. Principles of Multidimensional NMR Techniques for Measurement of J Coupling Constants.- 5. Comparision of the NMR and X-Ray Structures of Hirudin.- 6. The Application of the Linear Prediction Principle to NMR Spectroscopy.- 7. NMR Data Processing and Structure Calculations Using Parallel Computers.- 8. Software Approaches for Determination of 3-Dimensional Molecular Structures from Multi-Dimensional NMR.- 9. Applicability and Limitations of Three-Dimensional NMR Spectroscopy for the Study of Proteins in Solution.- 10. The Role of Selective Two-Dimensional NMR Correlation Methods in Supplementing Computer-Supported Multiplet Analysis by MARCO POLO.- 11. Application of Maximum Entropy Methods to NMR Spectra of Proteins.- 12. Pattern Recognition in Two-Dimensional NMR Spectra of Proteins.- 13. The Application and Development of Software Tools for the Processing and Analysis of Heteronuclear Multi-Dimensional NMR Data.- 14. Distance Geometry in Torsion Angle Space: New Developments and Applications.- 15. Structure Determination by NMR: The Modeling of NMR Parameters as Ensemble Averages.- 16. Time Averaged Distance Restraints in NMR Based Structural Refinement.- 17. Analysis of Backbone Dynamics of Interleukin-1?.- 18. A New Version of DADAS (Distance Analysis in Dihedral Angle Space) and Its Performance.- 19. An Amateur Looks at Error Analysis in the Determination of Protein Structure by NMR.- 20. Structural Interpretation of NMR Data in the Presence of Motion.- 21. New Interactive and Automatic Algorithms for the Assignment of NMR Spectra.- 22. Outline of a Computer Program for the Analysis of Protein NMR Spectra.- 23. Assignment of the NMR Spectra of Homologous Proteins.- 24. Incorporation of Internal Motion in NMR Refinements Based on NOESY Data.- 25. Refinement of Three-Dimensional Protein and DNA Structures in Solution from NMR Data.- 26. How to Deal with Spin-Diffusion and Internal Mobility in Biomolecules. A Relaxation Matrix Approach.- 27. Interactive Computer Graphics in the Assignment of Protein 2D and 3D NMR Spectra.- 28. Determination of Large Protein Structures from NMR Data: Definition of the Solution Structure of the TRP Repressor.- 29. Interpretation of NMR Data in Terms of Protein Structure: Summary of a Round Table Discussion.- 30. Fast Calculation of the Relaxation Matrix.- 31. NMR Structures of Proteins Using Stereospecific Assignments and Relaxation Matrix Refinement in a Hybrid Method of Distance Geometry and Simulated Annealing.- 32. A Critique of the Interpretation of Nuclear Overhauser Effects of Duplex DNA.- 33. Improvement in Resolution with Nonlinear Methods Applied to NMR Signals from Macromolecules.- 34. STELLA and CLAIRE: A Seraglio of Programs for Human-Aided Assignment of 2D 1H NMR Spectra of Proteins.- 35. MolSkop: Towards NMR Molecular Scope.- 36. Ribonuclease H: Full Assignment of Backbone Proton Resonances with Heteronuclear 3D NMR and Solution Structure.- 37. Sampling Properties of Simulated Annealing and Distance Geometry.- 38. Participants.- 39. Index.
Read More Show Less

Customer Reviews

Average Rating 5
( 1 )
Rating Distribution

5 Star


4 Star


3 Star


2 Star


1 Star


Your Rating:

Your Name: Create a Pen Name or

Barnes & Review Rules

Our reader reviews allow you to share your comments on titles you liked, or didn't, with others. By submitting an online review, you are representing to Barnes & that all information contained in your review is original and accurate in all respects, and that the submission of such content by you and the posting of such content by Barnes & does not and will not violate the rights of any third party. Please follow the rules below to help ensure that your review can be posted.

Reviews by Our Customers Under the Age of 13

We highly value and respect everyone's opinion concerning the titles we offer. However, we cannot allow persons under the age of 13 to have accounts at or to post customer reviews. Please see our Terms of Use for more details.

What to exclude from your review:

Please do not write about reviews, commentary, or information posted on the product page. If you see any errors in the information on the product page, please send us an email.

Reviews should not contain any of the following:

  • - HTML tags, profanity, obscenities, vulgarities, or comments that defame anyone
  • - Time-sensitive information such as tour dates, signings, lectures, etc.
  • - Single-word reviews. Other people will read your review to discover why you liked or didn't like the title. Be descriptive.
  • - Comments focusing on the author or that may ruin the ending for others
  • - Phone numbers, addresses, URLs
  • - Pricing and availability information or alternative ordering information
  • - Advertisements or commercial solicitation


  • - By submitting a review, you grant to Barnes & and its sublicensees the royalty-free, perpetual, irrevocable right and license to use the review in accordance with the Barnes & Terms of Use.
  • - Barnes & reserves the right not to post any review -- particularly those that do not follow the terms and conditions of these Rules. Barnes & also reserves the right to remove any review at any time without notice.
  • - See Terms of Use for other conditions and disclaimers.
Search for Products You'd Like to Recommend

Recommend other products that relate to your review. Just search for them below and share!

Create a Pen Name

Your Pen Name is your unique identity on It will appear on the reviews you write and other website activities. Your Pen Name cannot be edited, changed or deleted once submitted.

Your Pen Name can be any combination of alphanumeric characters (plus - and _), and must be at least two characters long.

Continue Anonymously
Sort by: Showing 1 Customer Reviews
  • Posted June 19, 2013

    I¿m loving McDonalds for fast food... MyDeals247 for the best de

    I’m loving McDonalds for fast food... MyDeals247 for the best deals;))

    Was this review helpful? Yes  No   Report this review
Sort by: Showing 1 Customer Reviews

If you find inappropriate content, please report it to Barnes & Noble
Why is this product inappropriate?
Comments (optional)