Computational Chemogenomics
Humana Press Inc. (Verlag)
978-1-4939-9350-5 (ISBN)
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.
A Survey of Web-Based Chemogenomic Data Resources.- Finding Potential Multi-Target Ligands Using PubChem.- Fundamental Bioinformatic and Chemoinformatic Data Processing.- Parsing Compound-Protein Bioactivity Tables.- Impact of Molecular Descriptors on Computational Models.- Physicochemical Property Labels as Molecular Descriptors for Improved Analysis of Compound-Protein and Compound-Compound Networks.- Core Statistical Methods for Chemogenomic Data.- Structure-Based Detection of Orthosteric and Allosteric Pockets at Protein-Protein Interfaces.- Single Binding Pockets versus Allosteric Binding.- Mapping Biological Activities to Different Types of Molecular Scaffolds: Exemplary Application to Protein Kinase Inhibitors.- SAR Matrix Method for Large-Scale Analysis of Compound Structure-Activity Relationships and Exploration of Multi-Target Activity Spaces.- Linear and Kernel Model Construction Methods for Predicting Drug-Target Interactions in a Chemogenomic Framework.- Selection of Informative Examples in Chemogenomic Datasets.- A Platform for Comprehensive Genomic Profiling in Human Cancers and Pharmacogenomics Therapy Selection.- The Future of Computational Chemogenomics.
Erscheinungsdatum | 04.12.2019 |
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Reihe/Serie | Methods in Molecular Biology ; 1825 |
Zusatzinfo | 147 Illustrations, color; 54 Illustrations, black and white; XII, 454 p. 201 illus., 147 illus. in color. |
Verlagsort | Totowa, NJ |
Sprache | englisch |
Maße | 178 x 254 mm |
Themenwelt | Mathematik / Informatik ► Informatik ► Theorie / Studium |
Informatik ► Weitere Themen ► Bioinformatik | |
Naturwissenschaften ► Biologie ► Genetik / Molekularbiologie | |
Schlagworte | Chemical activity data • Chemical toxicity screening • Compound-protein interaction • Data processing • drug discovery • Protein targets • Structural Analysis • Translational research |
ISBN-10 | 1-4939-9350-X / 149399350X |
ISBN-13 | 978-1-4939-9350-5 / 9781493993505 |
Zustand | Neuware |
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