Generative artificial intelligence in drug discovery: basic framework, recent advances, challenges, and opportunities

There are two main ways to discover or design small drug molecules. The first involves fine-tuning existing molecules or commercially successful drugs through quantitative structure-activity relationships and virtual screening. The second approach involves generating new molecules through de novo dr...

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Príomhchruthaitheoirí: Amit Gangwal, Azim Ansari, Iqrar Ahmad, Abul Kalam Azad, Vinoth Kumarasamy, Vetriselvan Subramaniyan, Ling Shing Wong
Formáid: Alt
Teanga:English
Foilsithe / Cruthaithe: Frontiers Media S.A. 2024-02-01
Sraith:Frontiers in Pharmacology
Ábhair:
Rochtain ar líne:https://www.frontiersin.org/articles/10.3389/fphar.2024.1331062/full