Article

Generative AI-assisted Virtual Screening Pipeline for Generalizable and Efficient Drug Repurposing

2024-12-11

Abstract excerpt

Drug repurposing presents a valuable strategy to expedite drug discovery by identifying new therapeutic uses for existing compounds, especially for diseases with limited treatment options. We propose a Generative AI-assisted Virtual Screening Pipeline that combines generative modeling, binding pocket prediction, and similarity-based searches within drug databases to achieve a generalizable and efficient approach t...

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Literature Corpus work: 5a4ffb5c-3acf-51de-9df4-e89124341058
DOI: 10.1101/2024.12.07.627340

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