Uses of Class
org.openscience.cdk.libio.md.MDMolecule
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Packages that use MDMolecule Package Description org.openscience.cdk.libio.md -
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Uses of MDMolecule in org.openscience.cdk.libio.md
Methods in org.openscience.cdk.libio.md that return MDMolecule Modifier and Type Method Description MDMoleculeChargeGroup. getParentMolecule()MDMoleculeResidue. getParentMolecule()Methods in org.openscience.cdk.libio.md with parameters of type MDMolecule Modifier and Type Method Description voidChargeGroup. setParentMolecule(MDMolecule parentMolecule)voidResidue. setParentMolecule(MDMolecule parentMolecule)Constructors in org.openscience.cdk.libio.md with parameters of type MDMolecule Constructor Description ChargeGroup(IAtomContainer container, int number, MDMolecule parentMolecule)Constructor to create a ChargeGroup based on an AC, a number, and a MDMolecule.Residue(IAtomContainer container, int number, MDMolecule parentMolecule)Constructor to create a Residue based on an AC, a number, and a MDMolecule.
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