Author

Xiaoxuan Shi

Listed by name: these papers carry no ORCID for this author, so different people with the same name may be mixed together.

Biology Disciplines

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Bioinformatics· 2

Signature Assays, Organisms & Methods

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Research Focus:benchmarking· 2 Research Focus:drug response / drug discovery· 2 Assay:protein structure· 2 Research Focus:software / tool· 2 Research Focus:database / resource· 1 Approach:deep learning· 1 Approach:experimental assay· 1 Approach:statistical model· 1

Frequent Co-Authors

Bo HuangiD· 2 shared Wei PengiD· 2 shared Wenbiao ZhouiD· 2 shared Xiaoman WangiD· 2 shared Cheng WangiD· 1 shared Hao‐Yu Chang· 1 shared Hongbo ZhangiD· 1 shared Jielong Zhou· 1 shared

Activity by Year

2022-2023 · peak 1/yr

Co-Author Collaboration Network

10 top collaborators · 37 mutual co-author links

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2 shared papersBioinformatics

Bo HuangORCID

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2 papers

Recent·Most cited

BioinformaticsCommunications ChemistryPeer-reviewedAug 22, 2023

Using macromolecular electron densities to improve the enrichment of active compounds in virtual screening

Wenzhi Ma, Wei Zhang, Yuan Le…·Bo Huang

This paper introduces ExptGMS, a method using experimental electron density data to improve virtual screening by enhancing active compound enrichment, achieving a 20% improvement and identifying new inhibitors.

10 citations

protein structureexperimental assay

𝕏 PostBluesky

BioinformaticsScientific ReportsPeer-reviewedSep 6, 2022

Thinking like a structural biologist: A pocket-based 3D molecule generative model fueled by electron density

Lvwei Wang, Rong Bai, Xiaoxuan Shi…·Bo Huang

The paper introduces a 3D molecule generative model using electron density data to create drug-like molecules that match target protein pockets and active compounds.

22 citations

protein structuredeep learning

𝕏 PostBluesky