Chemical Data Processing Library Python API - Version 1.1.1
Public Member Functions | List of all members
CDPL.Chem.BasicBond Class Reference

BasicBond. More...

+ Inheritance diagram for CDPL.Chem.BasicBond:

Public Member Functions

Bond assign (Bond bond)
 Assignment operator that replaces the current set of properties with the properties of bond;. More...
 
BasicBond assign (BasicBond bond)
 Assignment operator that replaces the current set of properties with the properties of bond;. More...
 
- Public Member Functions inherited from CDPL.Chem.Bond
None __init__ ()
 Initializes the Bond instance.
 
Atom getNeighbor (Bond self, Atom atom)
 
Atom getBegin ()
 Returns a reference to the start atom of the bond. More...
 
Atom getEnd ()
 Returns a reference to the end atom of the bond. More...
 
Molecule getMolecule ()
 Returns a reference to the parent molecule. More...
 
int getIndex ()
 Returns the index of the bond in its parent molecule. More...
 
object getAtoms ()
 
Atom getAtom (int idx)
 Returns a reference to the atom at index idx. More...
 
bool containsAtom (Atom atom)
 Tells whether the bond is incident to the specified atom. More...
 
int getAtomIndex (Atom atom)
 Returns the index of the specified atom. More...
 
int getNumAtoms ()
 Returns the number of atoms connected by the bond. More...
 
None orderAtoms (ForceField.InteractionFilterFunction2 func)
 
Entity3D getEntity (int idx)
 
int getNumEntities ()
 
bool __contains__ (Atom atom)
 Returns the result of the membership test operation atom in self. More...
 
bool __contains__ (Base.LookupKey key)
 Returns the result of the membership test operation key in self. More...
 
Base.Any __getitem__ (Base.LookupKey key)
 
None __setitem__ (Base.LookupKey key, Base.Any value)
 
bool __delitem__ (Base.LookupKey key)
 
int __len__ ()
 
- Public Member Functions inherited from CDPL.Chem.AtomContainer
Atom __getitem__ (int idx)
 
- Public Member Functions inherited from CDPL.Chem.Entity3DContainer
int getObjectID ()
 Returns the numeric identifier (ID) of the wrapped C++ class instance. More...
 
- Public Member Functions inherited from CDPL.Base.PropertyContainer
int getObjectID ()
 Returns the numeric identifier (ID) of the wrapped C++ class instance. More...
 
int getNumProperties ()
 Returns the number of property entries. More...
 
Any getPropertyOrDefault (LookupKey key, Any def_value)
 
list getPropertyKeys ()
 
list getPropertyValues ()
 
list getProperties ()
 Returns a reference to itself. More...
 
None setProperty (LookupKey key, Any value)
 
bool removeProperty (LookupKey key)
 Clears the value of the property specified by key. More...
 
Any getProperty (LookupKey key, bool throw_=False)
 Returns the value of the property specified by key. More...
 
bool isPropertySet (LookupKey key)
 Tells whether or not a value has been assigned to the property specified by key. More...
 
None clearProperties ()
 Clears all property values.
 
None addProperties (PropertyContainer cntnr)
 Adds the property value entries in the PropertyContainer instance cntnr. More...
 
None copyProperties (PropertyContainer cntnr)
 Replaces the current set of properties by a copy of the entries in cntnr. More...
 
None swap (PropertyContainer cntnr)
 Exchanges the properties of this container with the properties of the container cntnr. More...
 
Any __getitem__ (LookupKey key)
 
bool __contains__ (LookupKey key)
 Returns the result of the membership test operation key in self. More...
 
None __setitem__ (LookupKey key, Any value)
 
bool __delitem__ (LookupKey key)
 

Additional Inherited Members

- Properties inherited from CDPL.Chem.Bond
 begin = property(getBegin)
 
 end = property(getEnd)
 
 molecule = property(getMolecule)
 
 index = property(getIndex)
 
 atoms = property(getAtoms)
 
- Properties inherited from CDPL.Chem.AtomContainer
 numAtoms = property(getNumAtoms)
 
- Properties inherited from CDPL.Chem.Entity3DContainer
 objectID = property(getObjectID)
 
 numEntities = property(getNumEntities)
 
- Properties inherited from CDPL.Base.PropertyContainer
 objectID = property(getObjectID)
 
 propertyKeys = property(getPropertyKeys)
 
 propertyValues = property(getPropertyValues)
 
 properties = property(getProperties)
 
 numProperties = property(getNumProperties)
 

Detailed Description

BasicBond.

Member Function Documentation

◆ assign() [1/2]

Bond CDPL.Chem.BasicBond.assign ( Bond  bond)

Assignment operator that replaces the current set of properties with the properties of bond;.

Parameters
bondThe bond whose properties get copied.
Returns
self

Reimplemented from CDPL.Chem.Bond.

◆ assign() [2/2]

BasicBond CDPL.Chem.BasicBond.assign ( BasicBond  bond)

Assignment operator that replaces the current set of properties with the properties of bond;.

Parameters
bondThe bond whose properties get copied.
Returns
self