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Duangrudee Tanramluk on Muck Rack

Duangrudee Tanramluk

As seen in: Cell Press
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Articles

MANORAA: A machine learning platform to guide protein-ligand design by anchors and influential distances

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By Danaya Pakotiprapha, Duangrudee Tanramluk, Sakao Phoochaijaroen, Pattra Chantravisut
| Cell Press Verified
Highlights • This work extends our MANORAA platform for analyzing protein-ligand interactions • We provide algorithms to interpret drug binding affinities proven experimentally • Molecular anchors and effects of distance descriptors guide drug design • MANORAA also pinpoints the drug's side effects and target organs Summary The MANORAA platform uses structure-based approaches to provide information on drug design originally derived from mapping tens of thousands of amino acids on a grid.
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