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Book Categories |
Preface | ||
A Personal Foreword | ||
1 | Introduction | 1 |
2 | 3D QSAR: The Integration of QSAR with Molecular Modeling | 9 |
Chemometrics and Molecular Modeling | 9 | |
3D QSAR Methods | 39 | |
GOLPE: Philosophy and Applications in 3D QSAR | 61 | |
3 | Rational Use of Chemical and Sequence Databases | 89 |
Molecular Similarity Analysis: Applications in Drug Discovery | 89 | |
Clustering of Chemical Structure Databases for Compound Selection | 111 | |
Receptor Mapping and Phylogenetic Clustering | 131 | |
4 | Advanced Statistical Techniques | 163 |
Continuum Regression: A New Algorithm for the Prediction of Biological Activity | 163 | |
Molecular Taxonomy by Correspondence Factorial Analysis (CFA) | 190 | |
Analysis of Embedded Data: k-Nearest Neighbor and Single Class Discrimination | 228 | |
Quantitative Analysis of Structure-Activity-Class Relationships by (Fuzzy) Adaptive Least Squares | 244 | |
Alternating Conditional Expectations in QSAR | 281 | |
5 | Neural Networks and Expert Systems in Molecular Design | 293 |
Neural Networks - A Tool for Drug Design | 293 | |
Rule Induction Applied to the Derivation of Quantitative Structure-Activity Relationships | 319 | |
Index | 333 |
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Add Advanced Computer-Assisted Techniques in Drug Discovery, The use of powerful computers has revolutionized molecular design and drug discovery. Thoroughly researched and well-structured, this comprehensive handbook covers highly effective and efficient techniques in 3D-QSAR and advanced statistical analysis. The, Advanced Computer-Assisted Techniques in Drug Discovery to the inventory that you are selling on WonderClubX
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Add Advanced Computer-Assisted Techniques in Drug Discovery, The use of powerful computers has revolutionized molecular design and drug discovery. Thoroughly researched and well-structured, this comprehensive handbook covers highly effective and efficient techniques in 3D-QSAR and advanced statistical analysis. The, Advanced Computer-Assisted Techniques in Drug Discovery to your collection on WonderClub |