Chemical Data Processing Library Python API - Version 1.2.0
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Implements the perception of all pi electron systems present in a molecule. More...
Public Member Functions | |
None | __init__ () |
Constructs an empty PiElectronSystemList instance. | |
None | __init__ (MolecularGraph molgraph) |
Constructs a PiElectronSystemList instance storing all pi electron systems of the molecular graph molgraph. More... | |
None | perceive (MolecularGraph molgraph) |
Perceives all pi electron systems present in the molecular graph molgraph. More... | |
Public Member Functions inherited from CDPL.Chem.ElectronSystemList | |
None | __init__ (ElectronSystemList list) |
Initializes a copy of the ElectronSystemList instance list. More... | |
int | getObjectID () |
Returns the numeric identifier (ID) of the wrapped C++ class instance. More... | |
int | getSize () |
bool | isEmpty () |
None | resize (int num_elem, ElectronSystem value) |
None | reserve (int num_elem) |
int | getCapacity () |
None | clear () |
ElectronSystemList | assign (ElectronSystemList array) |
Replaces the current state of self with a copy of the state of the ElectronSystemList instance array. More... | |
None | assign (int num_elem, ElectronSystem value) |
None | addElement (ElectronSystem value) |
None | addElements (ElectronSystemList values) |
None | insertElement (int idx, ElectronSystem value) |
None | insertElements (int idx, int num_elem, ElectronSystem value) |
None | insertElements (int index, ElectronSystemList values) |
None | popLastElement () |
None | removeElement (int idx) |
None | removeElements (int begin_idx, int end_idx) |
ElectronSystem | getFirstElement () |
ElectronSystem | getLastElement () |
ElectronSystem | getElement (int idx) |
None | setElement (int idx, ElectronSystem value) |
None | __delitem__ (int idx) |
ElectronSystem | __getitem__ (int idx) |
int | __len__ () |
None | __setitem__ (int index, ElectronSystem value) |
bool | __eq__ (object list) |
Returns the result of the comparison operation self == list . More... | |
bool | __ne__ (object list) |
Returns the result of the comparison operation self != list . More... | |
Additional Inherited Members | |
Properties inherited from CDPL.Chem.ElectronSystemList | |
objectID = property(getObjectID) | |
size = property(getSize) | |
Implements the perception of all pi electron systems present in a molecule.
None CDPL.Chem.PiElectronSystemList.__init__ | ( | MolecularGraph | molgraph | ) |
Constructs a PiElectronSystemList
instance storing all pi electron systems of the molecular graph molgraph.
molgraph | The molecular graph for which to perceive the pi electron systems. |
None CDPL.Chem.PiElectronSystemList.perceive | ( | MolecularGraph | molgraph | ) |
Perceives all pi electron systems present in the molecular graph molgraph.
molgraph | The molecular graph for which to perceive the pi electron systems. |