Articles with "prediction biomolecular" as a keyword



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GridSolvate: A Web Server for the Prediction of Biomolecular Hydration Properties

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Published in 2020 at "Journal of Chemical Information and Modeling"

DOI: 10.1021/acs.jcim.0c00779

Abstract: We present a novel web server, named gridSolvate, dedicated to the prediction of biomolecular hydration properties. Given a solute in atomic representation, such as a protein or protein–ligand complex, the server determines positions and excess… read more here.

Keywords: prediction biomolecular; biomolecular hydration; web server; hydration properties ... See more keywords