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PharmacoForge: pharmacophore generation with diffusion models

Structure-based drug design (SBDD) is enhanced by machine learning (ML) to improve both virtual screening and de novo design. Despite advances in ML tools for both strategies, screening remains bounded by time and computational cost, while generative models frequently produce invalid and synthetical...

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Detaylı Bibliyografya
Asıl Yazarlar: Emma L. Flynn, Riya Shah , Ian Dunn , Rishal Aggarwal , David Ryan Koes 
Materyal Türü: Artigo
Dil:Inglês
Baskı/Yayın Bilgisi: Frontiers Media S.A. 2025-09-01
Seri Bilgileri:Frontiers in Bioinformatics
Konular:
Online Erişim:https://www.frontiersin.org/articles/10.3389/fbinf.2025.1628800/full
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