did-you-know? rent-now

Amazon no longer offers textbook rentals. We do!

did-you-know? rent-now

Amazon no longer offers textbook rentals. We do!

We're the #1 textbook rental company. Let us show you why.

9780841234901

Designing Bioactive Molecules Three-Dimensional Techniques and Applications

by ;
  • ISBN13:

    9780841234901

  • ISBN10:

    0841234906

  • Format: Hardcover
  • Copyright: 1997-11-27
  • Publisher: American Chemical Society

Note: Supplemental materials are not guaranteed with Rental or Used book purchases.

Purchase Benefits

  • Free Shipping Icon Free Shipping On Orders Over $35!
    Your order must be $35 or more to qualify for free economy shipping. Bulk sales, PO's, Marketplace items, eBooks and apparel do not qualify for this offer.
  • eCampus.com Logo Get Rewarded for Ordering Your Textbooks! Enroll Now
  • Write a Review Icon Write a Review
List Price: $61.71 Save up to $18.51
  • Rent Book $43.20
    Add to Cart Free Shipping Icon Free Shipping

    TERM
    PRICE
    DUE
    USUALLY SHIPS IN 3-5 BUSINESS DAYS
    *This item is part of an exclusive publisher rental program and requires an additional convenience fee. This fee will be reflected in the shopping cart.

Supplemental Materials

What is included with this book?

Summary

Three-dimensional structural information often provides the key to discovering or designing bioactive molecules and compounds. This volume covers the principal computational techniques for processing three-dimensional structures of small molecules and compounds. It describes databaseconstruction and searching, analysis of structure-activity relationships by pharmacophore mapping and QSAR, prediction of biological potency of small molecules and compounds by QSAR and by docking to macromolecular targets. The book also includes a chapter on de novo design of ligands to fit amacromolecular target.

Table of Contents

Contributors vii(2)
Preface ix
1. Database Searching: Past, Present, and Future
1(18)
Cynthia Corwin
Irwin D. Kuntz
Techniques 19(102)
2. Crystallographic Databases and Their Use for Studying Intermolecular Interactions
19(28)
Nigel A. Pitchford
Robin Taylor
3. Automated Three-Dimensional Structure Generation
47(26)
Darren V.S. Green
4. The Principles and Practice of Three-Dimensional Database Searching
73(24)
Wendy A. Warr
Peter Willett
5. Integration of Molecular Modeling and Database Searching
97(24)
Mark G. Bures
Applications 121(140)
6. Pharmacophore Mapping
121(28)
Yvonne Connolly Martin
7. Structure Generation for De Novo Design
149(26)
Valerie J. Gillet
A. Peter Johnson
8. Docking: Predicting the Structure and Binding Affinity of Ligand-Receptor Complexes
175(24)
J. Scott Dixon
Jeffrey M. Blaney
9. Calculation of Three-Dimensional Similarity
199(20)
Philip M. Dean
Tim D.J. Perkins
10. 3D-QSAR Methods
219(34)
Giovanni Greco
Ettore Novellino
Yvonne Connolly Martin
11. Summary and Future Developments
253(8)
Yvonne Connolly Martin
Peter Willett
Index 261

Supplemental Materials

What is included with this book?

The New copy of this book will include any supplemental materials advertised. Please check the title of the book to determine if it should include any access cards, study guides, lab manuals, CDs, etc.

The Used, Rental and eBook copies of this book are not guaranteed to include any supplemental materials. Typically, only the book itself is included. This is true even if the title states it includes any access cards, study guides, lab manuals, CDs, etc.

Rewards Program