Author

Kun Yao

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Molecular Biology· 1

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Research Focus:benchmarking· 1 Approach:deep learning· 1 Research Focus:drug response / drug discovery· 1 Approach:experimental assay· 1

Frequent Co-Authors

Da ShiiD· 1 shared Jumana DakkaiD· 1 shared Lukas HerroniD· 1 shared Steven V. JeromeiD· 1 shared Yuqi ZhangiD· 1 shared

Activity by Year

2026-2026 · peak 1/yr

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1 shared paperMolecular Biology

Da ShiORCID

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1 paper

Recent·Most cited

Molecular BiologyJournal of Chemical Information and ModelingPeer-reviewedApr 23, 2026

DiffDock-Glide: a hybrid physics-based and data-driven approach to molecular docking

Lukas Herron, Jumana Dakka, Kun Yao…·Steven V. Jerome

DiffDock-Glide improves molecular docking by combining a diffusion model with Glide's post-docking minimization, showing better performance on novel targets.

7 citationstop 1%

deep learningexperimental assay

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