Computer-Aided Drug Design

Computer-Aided Drug Design

Singh, Dev Bukhsh

Springer Verlag, Singapore

10/2021

306

Mole

Inglês

9789811568176

15 a 20 dias

492

Descrição não disponível.
1 Computational Approaches in Drug Discovery and Design.- 2 Molecular Modeling of Proteins: Methods, Recent Advances and Future Prospects.- 3 Cavity/Binding Site Prediction Approaches, and their Applications.- 4 Role of ADMET Tools in Current Scenario; Application and Limitations.- 5 Database Resources for Drug Discovery.- 6 Molecular Docking and Structure-Based Drug Design.- 7 Molecular Dynamics Simulation of Protein and Protein-Ligand Complexes.- 8 Computational Approaches for Drug Target Identification.- 9 Computational Screening Techniques for Lead Design and Development.- 10 Advances in Pharmacophore Modeling and its Role in Drug Designing.- 11 In Silico Designing of Vaccines: Methods, Tools and Their Limitations.- 12 Machine learning Approaches to Rational Drug Design.
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Pharmacophore modeling;Lead compounds;Molecular Docking;Molecular Dynamics simulation;Pharmacokinetics and Pharmacodynamics;ADMET