List of Contributors

Karl Thomae GmbH Chemical Department Birkendorfer Stra e 65 Postfach 1755 D-88397 Biberach an der Riss 1, Germany Tel. +497351542974 Fax +497351542165 Dr. Daniel Chessel Universit Lyon I URA CNRS 1451 F-69622 Villeurbanne, France Prof. Sergio Clementi Laboratorio di Chemiometria Dipartimento di Chimica Universit di Perugia Via Elce di Sotto 8 1-06123 Perugia, Italy Tel. and Fax +397545646 gabri chemiome.chm.unipg.it Dr. Gabriele Costantino Istituto di Chimica Farmac...

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An Atom-Level Description of Structure 40 2.2.2.2 The Intrinsic State of an Atom 41 2.2.2.3 The Field Effect on Each Atom 43 2.2.3 Strategies for Use of E-State Indices 44 2.2.4 Examples of E-State QSAR 44 2.2.4.1 MAO Inhibition with Hydrazides 44 2.2.4.2 Adenosine A, Inhibitors 45 2.2.4.3 Anesthetic Concentration of Haloalkanes 45 2.2.4.4 Odor Sensitivity of Pyrazines 46 2.2.5 Conclusions 46 References 47 3 Experimental Design in Synthesis Planning and Structure-Property Correlations 49 3.1.1...