/// <seealso cref="SetOfAtomContainersManipulator"> /// </seealso> public static double getTotalFormalCharge(ISetOfMolecules set_Renamed) { return(SetOfAtomContainersManipulator.getTotalFormalCharge(set_Renamed)); }
/// <seealso cref="SetOfAtomContainersManipulator"> /// </seealso> public static int getTotalHydrogenCount(ISetOfMolecules set_Renamed) { return(SetOfAtomContainersManipulator.getTotalHydrogenCount(set_Renamed)); }
public static void removeElectronContainer(ISetOfMolecules set_Renamed, IElectronContainer electrons) { SetOfAtomContainersManipulator.removeElectronContainer(set_Renamed, electrons); }
/// <summary> Returns all the AtomContainer's of a SetOfMolecules.</summary> public static IAtomContainer[] getAllAtomContainers(ISetOfMolecules set_Renamed) { return(SetOfAtomContainersManipulator.getAllAtomContainers(set_Renamed)); }
public static void removeAtomAndConnectedElectronContainers(ISetOfMolecules set_Renamed, IAtom atom) { SetOfAtomContainersManipulator.removeAtomAndConnectedElectronContainers(set_Renamed, atom); }
public static int getBondCount(ISetOfAtomContainers set_Renamed) { return(SetOfAtomContainersManipulator.getBondCount(set_Renamed)); }
public static System.Collections.IList getAllChemObjects(ISetOfMolecules set_Renamed) { return(SetOfAtomContainersManipulator.getAllChemObjects(set_Renamed)); }
public static IAtomContainer getRelevantAtomContainer(ISetOfMolecules moleculeSet, IBond bond) { return(SetOfAtomContainersManipulator.getRelevantAtomContainer(moleculeSet, bond)); }
public static void setAtomProperties(ISetOfMolecules set_Renamed, System.Object propKey, System.Object propVal) { SetOfAtomContainersManipulator.setAtomProperties(set_Renamed, propKey, propVal); }