MolInfo

inner class MolInfo(mol: Molecule, molType: MoleculeType)

Functions

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fun makeNewPosition(): ConformationEditor.PosInfo
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fun removePosition(posInfo: ConformationEditor.PosInfo)

Properties

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val label: String
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val mol: Molecule
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val molType: MoleculeType
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val motionInfos: MutableList<ConformationEditor.MotionInfo>
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val motions: MutableList<MolMotion.Description>
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var numConfs: BigInteger
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val posInfos: ArrayList<ConformationEditor.PosInfo>