Computer Aided Drug Design (CADD): From Ligand-Based Methods to Structure-Based Approaches

Computer Aided Drug Design (CADD): From Ligand-Based Methods to Structure-Based Approaches

Author: Mithun Rudrapal

Publisher: Elsevier

ISBN: 9780323914338

Category: Science

Page: 322

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Computer-Aided Drug Design (CADD): From Ligand-Based Methods to Structure-Based Approaches outlines the basic theoretical principles, methodologies and applications of different fundamental and advanced CADD approaches and techniques. Including information on current protocols as well as recent developments in the computational methods, tools and techniques used for rational drug design, the book explains the fundamental aspects of CADD, combining this with a practical understanding of the various in silico approaches used in modern drug discovery processes to assess the field in a comprehensive and systematic manner. Providing up-to-date, information and guidance for scientists, researchers, students and teachers, the book helps readers address specific academic and research related problems using illustrative explanations, examples and case studies, which are systematically reviewed. Highlights in silico approaches to drug design and discovery using computational tools and techniques Details ligand-based and structure-based drug design in a comprehensive and systematic approach Summarizes recent developments in computational drug design strategy as novel approaches of rational drug designing
Computer Aided Drug Design (CADD): From Ligand-Based Methods to Structure-Based Approaches
Language: en
Pages: 322
Authors: Mithun Rudrapal, Chukwuebuka Egbuna
Categories: Science
Type: BOOK - Published: 2022-06-01 - Publisher: Elsevier

Computer-Aided Drug Design (CADD): From Ligand-Based Methods to Structure-Based Approaches outlines the basic theoretical principles, methodologies and applications of different fundamental and advanced CADD approaches and techniques. Including information on current protocols as well as recent developments in the computational methods, tools and techniques used for rational drug design, the
Chemoinformatics Approaches to Structure- and Ligand-Based Drug Design
Language: en
Pages:
Authors: Adriano D. Andricopulo, Leonardo L. G. Ferreira
Categories: Science
Type: BOOK - Published: 2019-02-05 - Publisher: Frontiers Media SA

Chemoinformatics is paramount to current drug discovery. Structure- and ligand-based drug design strategies have been used to uncover hidden patterns in large amounts of data, and to disclose the molecular aspects underlying ligand-receptor interactions. This Research Topic aims to share with a broad audience the most recent trends in the
Chemoinformatics Approaches to Structure- and Ligand-Based Drug Design, Volume II
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Authors: Adriano D. Andricopulo, Leonardo L. G. Ferreira
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Computational Approaches for Novel Therapeutic and Diagnostic Designing to Mitigate SARS-CoV2 Infection: Revolutionary Strategies to Combat Pandemics compiles information about various computational bioinformatic approaches that can help combat viral infection. The book includes working knowledge of various molecular docking and molecular dynamic simulation approaches that have been exploited for drug
3D Enantioselective Descriptors for Ligand-based Computer-aided Drug Design
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Pages: 67
Authors: Gregory Richard Sliwoski
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Type: BOOK - Published: 2012 - Publisher:

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