Index
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M
- Mg - Enum constant in enum class qsardes.elements.ElementsEnum
- Mn - Enum constant in enum class qsardes.elements.ElementsEnum
- Mo - Enum constant in enum class qsardes.elements.ElementsEnum
- Molecule - Class in qsardes.molecule
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Clones the internal molecular representation of a MoleculeBuilder object and adds manipulators and calculators.
- Molecule(AbstractMoleculeBuilder) - Constructor for class qsardes.molecule.Molecule
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Constructs a molecular representation.
- Molecule.IntrState - Record Class in qsardes.molecule
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Stores the atomic intrinsic state, sigma and valence electrons count.
- MoleculeBuilderQsarME - Class in qsardes.molecule
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This class builds a QSAR-ME Profiler compliant molecular representation.
- MoleculeBuilderQsarME(String) - Constructor for class qsardes.molecule.MoleculeBuilderQsarME
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Constructs a molecular representation QSAR-ME Profiler compliant.
- MoleculeBuilderQsarWB - Class in qsardes.molecule
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This class builds a QSAR-WB Descriptors compliant molecular representation.
- MoleculeBuilderQsarWB(String) - Constructor for class qsardes.molecule.MoleculeBuilderQsarWB
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Constructs a molecular representation QSAR-WB Descriptors compliant.
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