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Bioinformatics Techniques for Drug Discovery [electronic resource] : Applications for Complex Diseases / by Aman Chandra Kaushik, Ajay Kumar, Shiv Bharadwaj, Ravi Chaudhary, Shakti Sahi.

By: Contributor(s): Material type: TextSeries: Publisher: Cham : Springer International Publishing : Imprint: Springer, 2018Edition: 1st ed. 2018Description: XI, 57 p. 8 illus., 7 illus. in color. online resourceContent type:
  • text
Media type:
  • computer
Carrier type:
  • online resource
ISBN:
  • 9783319757322
Subject(s): DDC classification:
  • 570.285 23
  • 570.113 23
Online resources:
Contents:
Brief Introduction -- Ligand-Based Approaches for Drug Design Using Computational Techniques -- Structure-Based Approaches for Drug Design Using Computational Technique -- Three-Dimensional Pharmacophore Modeling-Based Drug Design Using Computational Techniques -- Molecular Dynamics Simulation Approaches to Investigate the Dynamic Behavior of a System Through the Application of Newtonian Mechanics -- Receptor Thermodynamics of Ligand−Receptor and Ligand−Enzyme Association -- Thermodynamics Cycles and Their Application in Protein Targets -- Genomics and Proteomics Using Computational Biology.
Summary: The application of bioinformatics approaches in drug design involves an interdisciplinary array of sophisticated techniques and software tools to elucidate hidden or complex biological data. This work reviews the latest bioinformatics approaches used for drug discovery. The text covers ligand-based and structure-based approaches for computer-aided drug design, 3D pharmacophore modeling, molecular dynamics simulation, the thermodynamics of ligand−receptor and ligand−enzyme association, thermodynamic characterization and optimization, and techniques for computational genomics and proteomics.
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Brief Introduction -- Ligand-Based Approaches for Drug Design Using Computational Techniques -- Structure-Based Approaches for Drug Design Using Computational Technique -- Three-Dimensional Pharmacophore Modeling-Based Drug Design Using Computational Techniques -- Molecular Dynamics Simulation Approaches to Investigate the Dynamic Behavior of a System Through the Application of Newtonian Mechanics -- Receptor Thermodynamics of Ligand−Receptor and Ligand−Enzyme Association -- Thermodynamics Cycles and Their Application in Protein Targets -- Genomics and Proteomics Using Computational Biology.

The application of bioinformatics approaches in drug design involves an interdisciplinary array of sophisticated techniques and software tools to elucidate hidden or complex biological data. This work reviews the latest bioinformatics approaches used for drug discovery. The text covers ligand-based and structure-based approaches for computer-aided drug design, 3D pharmacophore modeling, molecular dynamics simulation, the thermodynamics of ligand−receptor and ligand−enzyme association, thermodynamic characterization and optimization, and techniques for computational genomics and proteomics.

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