#include <Eigen/Sparse>

Include dependency graph for InteractionExclusion.h:

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Classes
class	Scine::MolecularMechanics::InteractionExclusion
	This class provides a framework to store exclusions of interactions between atoms. Such exclusions are required for the non-covalent interactions between bonded atoms or to eliminate contributions to the energy for the interaction between QM atoms in QM/MM. More...

Detailed Description

Copyright: This code is licensed under the 3-clause BSD license.
Copyright ETH Zurich, Department of Chemistry and Applied Biosciences, Reiher Group.
See LICENSE.txt for details.

Classes