Class Scine::Utils::StructureDependentInitializer¶
-
class
StructureDependentInitializer
¶ Interface for method-specific settings which must be updated f.i. when the molecular structure changes.
Public Functions
-
virtual void
initialize
(const Utils::ElementTypeCollection &elements) = 0¶ Initialize the method after the parameters have been set or loaded.
-
virtual void