TY  - CHAP
AU  - Yu-Chen Lo
AU  - Gui Ren
AU  - Hiroshi Honda
AU  - Kara L. Davis
ED  - Amalia Stefaniu
ED  - Azhar Rasul
ED  - Ghulam Hussain
Y1  - 2019-09-10
PY  - 2019
T1  - Artificial Intelligence-Based Drug Design and Discovery
N2  - Cheminformatics has emerged as an applied branch of Chemistry that involves multidisciplinary knowledge, connecting related fields such as chemistry, computer science, biology, pharmacology, physics, and mathematical statistics.The book is organized in two sections, including multiple aspects related to advances in the development of informatic tools and their specific use in compound structure databases with various applications in life sciences, mainly in medicinal chemistry, for identification and development of new therapeutically active molecules. The book covers aspects related to genomic analysis, semantic similarity, chemometrics, pattern recognition techniques, chemical reactivity prediction, drug-likeness assessment, bioavailability, biological target recognition, machine-based drug discovery and design. Results from various computational tools and methods are discussed in the context of new compound design and development, sharing promising opportunities, and perspectives.
BT  - Cheminformatics and its Applications
SP  - Ch. 10
UR  - https://doi.org/10.5772/intechopen.89012
DO  - 10.5772/intechopen.89012
SN  - 978-1-83880-068-0
PB  - IntechOpen
CY  - Rijeka
Y2  - 2024-04-25
ER  -