Abstract:Ionic liquids (ILs) possess a unique physicochemical profile providing a wide range of applications. However, their "greenness", specifically their claimed relative non toxicity has been frequently questioned, hindering their REACH registration processes and so, their final application. In this work we introduce a reliable, predictive, simple and chemically interpretable classification and regression tree (CART) classifier enabling the prioritization of ILs with a favourable cytotoxicity profile. By inspecting… Show more
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