The recent advances in the approach of artificial intelligence (AI) towards drug discovery

Khan, Mahroza Kanwal1; Raza, Mohsin2; Shahbaz, Muhammad2; Hussain, Iftikhar3,4,5; Khan, Muhammad Farooq6; Xie, Zhongjian7; Shah, Syed Shoaib Ahmad8; Tareen, Ayesha Khan9; Bashir, Zoobia1; Khan, Karim2

2024-05-31

10.3389/fchem.2024.1408740

FRONTIERS IN CHEMISTRY   影响因子和分区

2296-2646

Artificial intelligence (AI) has recently emerged as a unique developmental influence that is playing an important role in the development of medicine. The AI medium is showing the potential in unprecedented advancements in truth and efficiency. The intersection of AI has the potential to revolutionize drug discovery. However, AI also has limitations and experts should be aware of these data access and ethical issues. The use of AI techniques for drug discovery applications has increased considerably over the past few years, including combinatorial QSAR and QSPR, virtual screening, and denovo drug design. The purpose of this survey is to give a general overview of drug discovery based on artificial intelligence, and associated applications. We also highlighted the gaps present in the traditional method for drug designing. In addition, potential strategies and approaches to overcome current challenges are discussed to address the constraints of AI within this field. We hope that this survey plays a comprehensive role in understanding the potential of AI in drug discovery.

AI drug discovery machine learning structure-activity relationship artificial intelligence

SCI

英语

其他

Chemistry

Chemistry, Multidisciplinary

WOS:001246676400001

FRONTIERS MEDIA SA

Web of Science

1.Shenzhen Univ, Coll Chem & Environm Engn, Shenzhen, Peoples R China
2.Shenzhen Univ, Addit Mfg Inst, Shenzhen, Peoples R China
3.City Univ Hong Kong, Dept Mech Engn, Kowloon, Hong Kong, Peoples R China
4.Drexel Univ, AJ Drexel Nanomat Inst, Philadelphia, PA USA
5.Drexel Univ, Dept Mat Sci & Engn, Philadelphia, PA USA
6.Sejong Univ, Dept Elect Engn, Seoul, South Korea
7.Southern Univ Sci & Technol, Shenzhen Childrens Hosp, Clin Med Coll, Shenzhen, Peoples R China
8.Natl Univ Sci & Technol, Sch Nat Sci, Dept Chem, Islamabad, Pakistan
9.Dongguan Univ Technol, Sch Mech Engn, Dongguan, Peoples R China

Khan, Mahroza Kanwal,Raza, Mohsin,Shahbaz, Muhammad,et al. The recent advances in the approach of artificial intelligence (AI) towards drug discovery[J]. FRONTIERS IN CHEMISTRY,2024,12.

Khan, Mahroza Kanwal.,Raza, Mohsin.,Shahbaz, Muhammad.,Hussain, Iftikhar.,Khan, Muhammad Farooq.,...&Khan, Karim.(2024).The recent advances in the approach of artificial intelligence (AI) towards drug discovery.FRONTIERS IN CHEMISTRY,12.

Khan, Mahroza Kanwal,et al."The recent advances in the approach of artificial intelligence (AI) towards drug discovery".FRONTIERS IN CHEMISTRY 12(2024).