Improved understanding of aqueous solubility modeling through topological data analysis

Mariam Pirashvili, Lee Steinberg, Francisco Belchí Guillamón, Mahesan Niranjan, Jeremy G. Frey, Jacek Brodzki. Improved understanding of aqueous solubility modeling through topological data analysis. J. Cheminformatics, 10(1), 2018. [doi]

Abstract

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