Cover image for Quantitative drug design a critical introduction
Title:
Quantitative drug design a critical introduction
Author:
Martin, Yvonne Connolly, 1936-
ISBN:
9781420071009
Edition:
2nd ed.
Publication Information:
Boca Raton : CRC Press/Taylor & Francis, c2010.
Physical Description:
xv, 282 p. : ill.
Contents:
Overview of quantitative drug design -- Noncovalent interactions in biological systems -- Preparation of 3D structures of molecules for 3D QSAR -- Calculating physical properties of molecules -- Biological data -- Form of equations that relate potency and physical properties -- Statistical basis of regression and partial least-squares analysis -- Strategy for the statistical evaluation of a data set of related molecules -- Detailed examples of QSAR calculations on erythromycin esters -- Case studies -- Methods to approach other structure-activity problems.
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