Part I: Data Resources for Computational Chemogenomics
1. A Survey of Web-Based Chemogenomic Data Resources
Rasel Al Mahmud, Rifat Ara Najnin, and Ahsan Habib Polash
2. Finding Potential Multi-Target Ligands Using PubChem
Sunghwan Kim, Benjamin A. Shoemaker, Evan E. Bolton, and Stephen H. Bryant
Part II: Fundamental Data Processing
3. Fundamental Bioinformatic and Chemoinformatic Data Processing
J.B. Brown
4. Parsing Compound-Protein Bioactivity Tables
J.B. Brown
5. Impact of Molecular Descriptors on Computational Models
Francesca Grisoni, Viviana Consonni, and Roberto Todeschini
6. Physicochemical Property Labels as Molecular Descriptors for Improved Analysis of Compound-Protein and Compound-Compound Networks
Masaaki Kotera
7. Core Statistical Methods for Chemogenomic Data
Christin Rakers
Part III: Structural Analysis Methods in 2D and 3D
8. Structure-Based Detection of Orthosteric and Allosteric Pockets at Protein-Protein Interfaces
Franck Da Silva and Didier Rognan
9. Single Binding Pockets versus Allosteric Binding
Kun Song and Jian Zhang
10. Mapping Biological Activities to Different Types of Molecular Scaffolds: Exemplary Application to Protein Kinase Inhibitors
Dilyana Dimova and Jürgen Bajorath
11. SAR Matrix Method for Large-Scale Analysis of Compound Structure-Activity Relationships and Exploration of Multi-Target Activity Spaces
Ye Hu and Jürgen Bajorath
Part IV: Statistical Pattern Recognition
12. Linear and Kernel Model Construction Methods for Predicting Drug-Target Interactions in a Chemogenomic Framework
Yoshihiro Yamanishi
13. Selection of Informative Examples in Chemogenomic Datasets
Daniel Reker and J.B. Brown
Part V: Emerging Topics
14. A Platform for Comprehensive Genomic Profiling in Human Cancers and Pharmacogenomics Therapy Selection
Tadayuki Kou, Masashi Kanai, Mayumi Kamada, Masahiko Nakatsui, Shigemi Matsumoto, Yasushi Okuno, and Manabu Muto
15. The Future of Computational Chemogenomics
Edgar Jacoby and J.B. Brown
Les informations fournies dans la section « Synopsis » peuvent faire référence à une autre édition de ce titre.
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Etat : New. Dieser Artikel ist ein Print on Demand Artikel und wird nach Ihrer Bestellung fuer Sie gedruckt. Includes cutting-edge methods for computational chemogenomicsProvides step-by-step detail essential for reproducible resultsContains key notes and implementation advice from the expertsThis thorough bo. N° de réf. du vendeur 220289445
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Buch. Etat : Neu. This item is printed on demand - it takes 3-4 days longer - Neuware -This thorough book provides a collection of techniques used in the emerging field of computational chemogenomics, which is an integration of chemoinformatics, bioinformatics, computer science, statistics, automated pattern recognition and modeling, database usage with data retrieval, and systems integration. Beginning with a section on public chemogenomic data resources, the volume continues by delving into the fundamentals of chemoinformatics, bioinformatics, and chemogenomic data processing. After the reader is comfortable with a core skillset, the volume introduces techniques to analyze specific proteins or compound structures and statistical pattern recognition techniques. Later chapters describe the future of chemogenomics including applications to medical care. Written for the highly successful Methods in Molecular Biology series, chapters include the kind of detailed implementation advice that serves as an ideal guide in the lab.Practical and authoritative, Computational Chemogenomics will greatly aid experimental sciences who are novices to data processing and modeling, as well as those with computationally-oriented backgrounds wishing to engage in this scientific area, which is continually growing and expected to contribute to industry, academic, and government research projects. 468 pp. Englisch. N° de réf. du vendeur 9781493986385
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Buch. Etat : Neu. Druck auf Anfrage Neuware - Printed after ordering - This thorough book provides a collection of techniques used in the emerging field of computational chemogenomics, which is an integration of chemoinformatics, bioinformatics, computer science, statistics, automated pattern recognition and modeling, database usage with data retrieval, and systems integration. Beginning with a section on public chemogenomic data resources, the volume continues by delving into the fundamentals of chemoinformatics, bioinformatics, and chemogenomic data processing. After the reader is comfortable with a core skillset, the volume introduces techniques to analyze specific proteins or compound structures and statistical pattern recognition techniques. Later chapters describe the future of chemogenomics including applications to medical care. Written for the highly successful Methods in Molecular Biology series, chapters include the kind of detailed implementation advice that serves as an ideal guide in the lab.Practical and authoritative, Computational Chemogenomics will greatly aid experimental sciences who are novices to data processing and modeling, as well as those with computationally-oriented backgrounds wishing to engage in this scientific area, which is continually growing and expected to contribute to industry, academic, and government research projects. N° de réf. du vendeur 9781493986385
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Buch. Etat : Neu. Neuware -This thorough book provides a collection of techniques used in the emerging field of computational chemogenomics, which is an integration of chemoinformatics, bioinformatics, computer science, statistics, automated pattern recognition and modeling, database usage with data retrieval, and systems integration. Beginning with a section on public chemogenomic data resources, the volume continues by delving into the fundamentals of chemoinformatics, bioinformatics, and chemogenomic data processing. After the reader is comfortable with a core skillset, the volume introduces techniques to analyze specific proteins or compound structures and statistical pattern recognition techniques. Later chapters describe the future of chemogenomics including applications to medical care. Written for the highly successful Methods in Molecular Biology series, chapters include the kind of detailed implementation advice that serves as an ideal guide in the lab.Humana Press in Springer Science + Business Media, Heidelberger Platz 3, 14197 Berlin 468 pp. Englisch. N° de réf. du vendeur 9781493986385
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