Package rdkit :: Package Chem :: Module rdMolDescriptors :: Class PropertyFunctor

Class PropertyFunctor

 object --+    
          |    
??.instance --+
              |
             PropertyFunctor

Known Subclasses:

PythonPropertyFunctor

Property computation class stored in the property registry.
See rdkit.Chem.rdMolDescriptor.Properties.GetProperty and 
rdkit.Chem.Descriptor.Properties.PropertyFunctor for creating new ones

Instance Methods

[hide private]

GetName(...)
GetName( (PropertyFunctor)arg1) -> str : Return the name of the property to calculate

GetVersion(...)
GetVersion( (PropertyFunctor)arg1) -> str : Return the version of the calculated property

__call__(...)
__call__( (PropertyFunctor)arg1, (Mol)arg2) -> float : Compute the property for the specified molecule

__init__(...)
Raises an exception...

__reduce__(...)
helper for pickle

Inherited from unreachable.instance: __new__

Inherited from object: __delattr__, __format__, __getattribute__, __hash__, __reduce_ex__, __repr__, __setattr__, __sizeof__, __str__, __subclasshook__

Properties

[hide private]

Inherited from object: __class__

Method Details

[hide private]

GetName(...)


GetName( (PropertyFunctor)arg1) -> str :
    Return the name of the property to calculate

    C++ signature :
        std::string GetName(RDKit::Descriptors::PropertyFunctor {lvalue})

GetVersion(...)


GetVersion( (PropertyFunctor)arg1) -> str :
    Return the version of the calculated property

    C++ signature :
        std::string GetVersion(RDKit::Descriptors::PropertyFunctor {lvalue})

call(...)
(Call operator)


__call__( (PropertyFunctor)arg1, (Mol)arg2) -> float :
    Compute the property for the specified molecule

    C++ signature :
        double __call__(RDKit::Descriptors::PropertyFunctor {lvalue},RDKit::ROMol)

init(...)
(Constructor)

Raises an exception
This class cannot be instantiated from Python

Overrides: object.__init__

reduce(...)

helper for pickle

Overrides: object.__reduce__: (inherited documentation)

Class PropertyFunctor

GetName(...)

GetVersion(...)

__call__(...) (Call operator)

__init__(...) (Constructor)

__reduce__(...)

call(...)
(Call operator)

init(...)
(Constructor)

reduce(...)