Package com.chemaxon.calculations.solubility

Interface SolubilityResult

  • @PublicAPI
public interface SolubilityResult
    Solubility prediction result.

    • Method Detail

      • getMolecule

        Molecule getMolecule()
        Returns the input molecule.
        Returns:
        the input molecule.

      • getSolubility

        double getSolubility()
        Returns the solubility value.
        Returns:
        the solubility value in logS unit

      • getSolubility

        double getSolubility​(SolubilityUnit unit)
        Returns the solubility value.
        Parameters:
        unit - solubility unit, see: SolubilityUnit
        Returns:
        the solubility value

      • getSolubilityCategory

        SolubilityCategory getSolubilityCategory​(SolubilityCategories categories)
        Returns the solubility category.
        Parameters:
        categories - solubility categories
        Returns:
        the solubility category