Package org.openscience.cdk.interfaces

Examples of org.openscience.cdk.interfaces.ISingleElectron

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   * openscience.cdk.interfaces.IAtom)
   */
  public void addSingleElectron(IAtom atom) {
    IAtomContainer relevantContainer = ChemModelManipulator
        .getRelevantAtomContainer(chemModel, atom);
    ISingleElectron singleElectron = atom.getBuilder().newInstance(ISingleElectron.class,atom);
    relevantContainer.addSingleElectron(singleElectron);
    updateAtom(atom);
    if (undoredofactory != null && undoredohandler != null) {
      IUndoRedoable undoredo = undoredofactory.getSingleElectronEdit(
          relevantContainer, singleElectron, true, this, atom,
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   */
  public void removeSingleElectron(IAtom atom) {
    IAtomContainer relevantContainer = ChemModelManipulator
        .getRelevantAtomContainer(chemModel, atom);
    if (relevantContainer.getConnectedSingleElectronsCount(atom) > 0) {
      ISingleElectron removedElectron = relevantContainer
          .removeSingleElectron(relevantContainer
              .getConnectedSingleElectronsCount(atom) - 1);
      updateAtom(atom);
      if (undoredofactory != null && undoredohandler != null) {
        IUndoRedoable undoredo = undoredofactory.getSingleElectronEdit(
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Related Classes of org.openscience.cdk.interfaces.ISingleElectron

  • org.openscience.jchempaint.controller.ControllerHub
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