/tools/DiffPhore

DiffPhore

VicFisher/DiffPhore

GitHub
datasetmodeltooldrug-discoveryvirtual-screening
46 stars8 forksPythonWebsiteAdded February 4, 2026
summary

DiffPhore is a tool that implements a knowledge-guided diffusion model for mapping ligands to pharmacophores in 3D space. It enhances virtual screening capabilities and provides datasets for pharmacophore-ligand pairs, making it useful for drug discovery applications.

description

Knowledge-Guided Diffusion Model for 3D Ligand-Pharmacophore Mapping

topics

pharmacophorevirtual-screeningmetalloenyzmeconformation-generationgeometric-deep-learningtarget-fishing

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