Chemical Data Processing Library Python API - Version 1.1.1
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A generic wrapper class used to store a user-defined numeric MMFF94 atom type function. More...
Public Member Functions | |
None | __init__ () |
Initializes the MMFF94NumericAtomTypeFunction instance. | |
None | __init__ (MMFF94NumericAtomTypeFunction func) |
Initializes a copy of the MMFF94NumericAtomTypeFunction instance func. More... | |
None | __init__ (object callable) |
Initializes the MMFF94NumericAtomTypeFunction instance. More... | |
int | __call__ (Chem.Atom arg1) |
bool | __bool__ () |
bool | __nonzero__ () |
A generic wrapper class used to store a user-defined numeric MMFF94 atom type function.
None CDPL.ForceField.MMFF94NumericAtomTypeFunction.__init__ | ( | MMFF94NumericAtomTypeFunction | func | ) |
Initializes a copy of the MMFF94NumericAtomTypeFunction instance func.
func | The MMFF94NumericAtomTypeFunction instance to copy. |
None CDPL.ForceField.MMFF94NumericAtomTypeFunction.__init__ | ( | object | callable | ) |
Initializes the MMFF94NumericAtomTypeFunction instance.
callable |
int CDPL.ForceField.MMFF94NumericAtomTypeFunction.__call__ | ( | Chem.Atom | arg1 | ) |
arg1 |
bool CDPL.ForceField.MMFF94NumericAtomTypeFunction.__bool__ | ( | ) |
bool CDPL.ForceField.MMFF94NumericAtomTypeFunction.__nonzero__ | ( | ) |