Solvmate – a hybrid bodily/ML option to solvent advice leveraging a rank-based drawback framework

Solvmate – a hybrid bodily/ML option to solvent advice leveraging a rank-based drawback framework

Digital Discovery, 2024, Advance Article
DOI: 10.1039/D4DD00138A, Paper
Open Access
Jan Wollschläger, Floriane Montanari
Reframing organic solubility as ranking leads to robust and generalizable models, and opens up new perspectives on this classic problem.
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