Computer-Aided Drug Design in Modern Drug Discovery
eBook - ePub

Computer-Aided Drug Design in Modern Drug Discovery

  1. English
  2. ePUB (mobile friendly)
  3. Available on iOS & Android
eBook - ePub

Computer-Aided Drug Design in Modern Drug Discovery

About this book

Computer-Aided Drug Design in Modern Drug Discovery offers an in-depth exploration of CADD, featuring real-world case studies and practical examples that empower researchers to effectively harness this technology in drug discovery and development. Exploring the intricacies of CADD, the book comprises several key chapters, beginning with an introduction to its methods and evolution that is followed by a thorough examination of the integration of artificial intelligence in drug design. Subsequent chapters cover various CADD approaches, including ligand-based, structure-based, and fragment-based design, alongside AI-driven compound generation and drug screening.The book also showcases a selection of marketed drugs developed with CADD or AI, such as Captopril, Tirofiban, and Crizotinib, providing invaluable insights into the successes and challenges faced in real-world applications. Finally, the discussion of emerging trends and future directions in CADD and AI highlights the ongoing evolution of these methodologies and their integration with traditional drug development processes. - Provides real-world case studies that demonstrate successful CADD applications in drug development - Simplifies complex concepts, making CADD accessible for researchers at all experience levels - Highlights emerging trends and future directions in CADD and AI for informed decision-making - Integrates theoretical knowledge with practical examples to enhance understanding and applications in drug discovery - Encourages innovative approaches to drug design through comprehensive insights and expert contributions

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Information

Publisher
Academic Press
Year
2026
eBook ISBN
9780443451065
Topic
Medicine
Subtopic
Pharmacology

Table of contents

  1. Title of Book
  2. Chapter 1 Introduction to computer-aided drug design
  3. Chapter 2 Introduction of AI in drug design
  4. Chapter 3 Approaches of computer-aided drug design/artificial intelligence in drug discovery
  5. Chapter 4 Boceprevir: A potent and selective NS3 protease inhibitor for the treatment of hepatitis C virus infection
  6. Chapter 5 Nolatrexed: A thymidylate synthase inhibitor for hepatocellular carcinoma (HCC)
  7. Chapter 6 Halicin: An AI-discovered novel broad-spectrum antibiotic for multidrug-resistant bacterial infections
  8. Chapter 7 Oseltamivir: A neuraminidase inhibitor for the treatment of influenza
  9. Chapter 8 Rentosertib: A TNIK inhibitor in clinical trials for idiopathic pulmonary fibrosis
  10. Chapter 9 Somatostatin and its analogues: Development and application of computer-aided drug design
  11. Chapter 10 SGR-1505: A MALT1 inhibitor in clinical trials for the treatment of relapsed/refractory B-cell malignancies
  12. Chapter 11 Sotorasib: A potent and selective inhibitor of KRAS G12C for the treatment of KRAS G12C-driven cancers
  13. Chapter 12 TAK-279: An oral allosteric TYK2 inhibitor in Phase 3 clinical trials for psoriasis
  14. Chapter 13 Venetoclax: An oral selective Bcl-2 inhibitor approved for chronic lymphocytic leukemia (CLL)
  15. Chapter 14 Emerging trends and future directions in computer-aided drug design and artificial intelligence
  16. Index

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Yes, you can access Computer-Aided Drug Design in Modern Drug Discovery by Yinuo Wu,Tianmiao Ou,Dongsheng Cao in PDF and/or ePUB format, as well as other popular books in Medicine & Pharmacology. We have over 1.5 million books available in our catalogue for you to explore.