Chemometric methods in molecular design

書誌事項

Chemometric methods in molecular design

edited by Han van de Waterbeemd

(Methods and principles in medicinal chemistry / edited by R. Mannhold ... [et al.], v. 2)

VCH, c1995

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注記

Includes bibliographical references

内容説明・目次

内容説明

This practice-oriented handbook provides a guide to modern chemometric methods in drug design. It presents strategies for making more rational choices in the planning of syntheses, and describes techniques for analyzing biological and chemical data.

目次

  • Molecular concepts
  • experimental design in synthesis-planning and structure-property correlations
  • multivariate analysis of chemical and biological data
  • statistical validation of QSAR results.

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