Author

Kevin Jose Cheng

IBM (United States)ORCID 0000-0001-5123-7831Unclaimed ORCID profile · follow to get notified of new preprints

Biology Disciplines

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Approach:deep learning· 1 Research Focus:protein folding & dynamics· 1 Assay:protein structure· 1 Approach:statistical model· 1

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Jie ShiiD· 1 shared Michael A. SaueriD· 1 shared Sara CapponiiD· 1 shared Taras V. PogoreloviD· 1 shared Tiffany J. CallahaniD· 1 shared

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2025-2025 · peak 1/yr

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1 shared paperBiochemistry

Jie ShiORCID

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1 paper

Recent·Most cited

BiochemistrybioRxivPreprintAug 18, 2025

Interpretable Machine Learning Uncovers Structural Determinants of Wnt-Wls Binding Specificity from Extended Atomistic Simulations

Tiffany J. Callahan, Jie Shi, Kevin Jose Cheng…·Sara Capponi

The paper uses machine learning on molecular dynamics simulations to identify key residues determining Wnt-Wls binding specificity across four Wnt proteins.

DOI 10.1101/2025.08.18.670971

protein structuredeep learning

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