most citedPredicting Aqueous Solubility of Organic Molecules Using Deep Learning Models with Varied Molecular Representations

83 citations · 83 across the 1 of their papers we have counts for

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cond-mat.mtrl-sci2021★ 83 cited

Predicting Aqueous Solubility of Organic Molecules Using Deep Learning Models with Varied Molecular Representations

Gihan Panapitiya, Michael Girard, Aaron Hollas +3

Determining the aqueous solubility of molecules is a vital step in many pharmaceutical, environmental, and energy storage applications. Despite efforts made over decades, there are…