Molecular Similarity in Drug Design

Editors: Dean, P.M. (Ed.)

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  • ISBN 978-94-011-1350-2
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About this book

Molecular similarity searching is fast becoming a key tool in organic chemistry. In this book, the editor has brought together an international team of authors, each working at the forefront of this technology, providing a timely and concise overview of current research. The chapters focus principally on those methods which have reached sufficient maturity to be of immediate practical use in molecular design.

Table of contents (12 chapters)

Table of contents (12 chapters)
  • Defining molecular similarity and complementarity for drug design

    Pages 1-23

    Dean, P. M.

  • 3D molecular similarity indices and their application in QSAR studies

    Pages 24-56

    Good, A. C.

  • The treatment of conformationally flexible molecules in similarity and complementarity searching

    Pages 57-88

    Leach, A. R.

  • Exploiting similarity between highly flexible and dissimilar molecular structures

    Pages 89-109

    Perkins, T. D. J.

  • Similarity-searching and clustering algorithms for processing databases of two-dimensional and three-dimensional chemical structures

    Pages 110-137

    Willett, P.

Buy this book

eBook 149,79 €
price for Spain (gross)
  • ISBN 978-94-011-1350-2
  • Digitally watermarked, DRM-free
  • Included format: PDF
  • Immediate eBook download after purchase and usable on all devices
  • Bulk discounts available
Hardcover 228,79 €
price for Spain (gross)
Softcover 187,19 €
price for Spain (gross)
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Bibliographic Information

Bibliographic Information
Book Title
Molecular Similarity in Drug Design
Editors
  • P.M. Dean
Copyright
1995
Publisher
Springer Netherlands
Copyright Holder
Springer Science+Business Media Dordrecht
eBook ISBN
978-94-011-1350-2
DOI
10.1007/978-94-011-1350-2
Hardcover ISBN
978-0-7514-0221-6
Softcover ISBN
978-94-010-4589-6
Edition Number
1
Number of Pages
XIV, 342
Topics