Litcius/Paper detail

Machine learning prediction of empirical polarity using SMILES encoding of organic solvents

Vaneet Saini

2022Molecular Diversity24 citationsDOI

Topics & Concepts

Artificial intelligenceComputer scienceMachine learningCheminformaticsCategorical variablePolarity (international relations)Artificial neural networkQuantum chemicalMolecular descriptorQuantitative structure–activity relationshipRepresentation (politics)ChemistryComputational chemistryMoleculeOrganic chemistryLawPoliticsPolitical scienceBiochemistryCellComputational Drug Discovery MethodsMachine Learning in Materials ScienceVarious Chemistry Research Topics