pydft_qmmm.interfaces.interfaceΒΆ

Base classes for software interfaces and related classes.

This module contains the software interface base class and the base classes for QM and MM interfaces, as well as the MM and QM potential and factory types.

Classes

MMInterface(system)

The abstract MM interface base class.

MMPotential(system)

A subclass of MM interface and potential for typing purposes.

QMInterface(system)

The abstract QM interface base class.

QMPotential(system)

A subclass of QM interface and potential for typing purposes.

SoftwareInterface(system)

The abstract software interface base class.