In Silico Chemistry and Biology

1. Auflage 2022
ISBN: 978-3-11-049517-1
Verlag: De Gruyter

Buch, Englisch, 197 Seiten, Format (B × H): 170 mm x 240 mm, Gewicht: 486 g

In Silico Chemistry and Biology: Current and Future Prospects provides a compact overview on recent advances in this highly dynamic branch of chemistry. Various methods of protein modelling and computer-assisted drug design are presented, including fragment- and ligand-based approaches. Many successful practical applications of these techniques are demonstrated. The authors also look to the future and describe the main challenges of the field.

Autoren/Hrsg.

Kumar Gupta, Girish

Baig, Mohammad Hassan

Fachgebiete

• Mathematik | Informatik EDV | Informatik Angewandte Informatik Bioinformatik
• Mathematik | Informatik EDV | Informatik Daten / Datenbanken Datenbankdesign & Datenbanktheorie
• Mathematik | Informatik EDV | Informatik Informatik Mensch-Maschine-Interaktion Informationsarchitektur
• Naturwissenschaften Biowissenschaften Angewandte Biologie Bioinformatik
• Naturwissenschaften Chemie Chemie Allgemein Chemometrik, Chemoinformatik
• Naturwissenschaften Biowissenschaften Biochemie (nichtmedizinisch)

Inhaltsverzeichnis

From the Content: - Different Methods for in silico Drug Discovery - Force Fields: Use and Applications - Protein Modelling - Molecular Docking and MD: Mimicking the Real Biological Process - Ligand-based Drug Design: Recent Advancements - Fragment-based Methods for Drug Discovery - Successful Applications of in silico Drug Design Processes

Über Autor(innen)

Girish Kumar Gupta, Sri Sai College of Pharmacy, India; Mohammad Hassan Baig, Gangnam Severance Hospital, Republic of Korea.