Buch, Englisch, 255 Seiten, Format (B × H): 160 mm x 241 mm, Gewicht: 1250 g
ISBN: 978-1-4020-1347-8
Verlag: Springer Netherlands
This book aims to provide an introduction to the major techniques of chemoinformatics. It is the first text written specifically for this field. The first part of the book deals with the representation of 2D and 3D molecular structures, the calculation of molecular descriptors and the construction of mathematical models. The second part describes other important topics including molecular similarity and diversity, the analysis of large data sets, virtual screening, and library design. Simple illustrative examples are used throughout to illustrate key concepts, supplemented with case studies from the literature.
Zielgruppe
Professional/practitioner
Autoren/Hrsg.
Fachgebiete
- Naturwissenschaften Chemie Physikalische Chemie Quantenchemie, Theoretische Chemie
- Naturwissenschaften Chemie Chemie Allgemein Toxikologie, Gefahrstoffe, Sicherheit in der Chemie
- Naturwissenschaften Chemie Chemie Allgemein Pharmazeutische Chemie, Medizinische Chemie
- Naturwissenschaften Chemie Chemie Allgemein Chemische Labormethoden, Stöchiometrie
- Technische Wissenschaften Verfahrenstechnik | Chemieingenieurwesen | Biotechnologie Kosmetische Technologie
- Medizin | Veterinärmedizin Medizin | Public Health | Pharmazie | Zahnmedizin Pharmazie
- Naturwissenschaften Chemie Chemie Allgemein Chemometrik, Chemoinformatik
Weitere Infos & Material
Representation And Manipulation Of 2D Molecular Structures.- Representation And Manipulation Of 3d Molecular Structures.- Molecular Descriptors.- Computational Models.- Similarity Methods.- Selecting Diverse Sets Of Compounds.- Analysis Of High-Throughput Screening Data.- Virtual Screening.- Combinatorial Chemistry And Library Design.
