Concepts and Experimental Protocols of Modelling and Informatics in Drug Design
Autor Om Silakari, Pankaj Kumar Singhen Limba Engleză Paperback – 10 noi 2020
The book is a valuable source for graduate students and researchers on bioinformatics, molecular modeling, biotechnology and several members of biomedical field who need to understand more about computer-aided molecular modeling.
- Presents exercises with solutions to aid readers in validating their own protocol
- Brings a thorough interpretation of results of each exercise to help readers compare them to their own study
- Explains each parameter utilized in the algorithms to help readers understand and manipulate various features of molecules and target protein to design their study
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Specificații
ISBN-13: 9780128205464
ISBN-10: 0128205466
Pagini: 396
Ilustrații: 150 illustrations (50 in full color)
Dimensiuni: 191 x 235 x 24 mm
Editura: ELSEVIER SCIENCE
ISBN-10: 0128205466
Pagini: 396
Ilustrații: 150 illustrations (50 in full color)
Dimensiuni: 191 x 235 x 24 mm
Editura: ELSEVIER SCIENCE
Public țintă
Bioinformaticians, molecular biologists, medicinal chemists, pharmacologistsCuprins
1. Fundamentals of molecular modeling2. Descriptor calculations for QSAR models3. Development of Hansch models and their validation4. QSAR model generation using Free Wilson approach5. QSAR model generation using mixed approach6. Exploration of protein databases for the selection and analysis of protein structure7. Utilization of protein sequence alignment tools8. Preparation of Homology modelled protein structures9. Molecular docking analysis for drug-receptor interactions10. 3D QSAR analysis11. Pharmacophore modeling for drug targets12. Molecular Dynamic simulations 13. Data retrieval system14. Molecular surfaces15. Freewares and Online servers