ScaledInteractions.h File Reference

#include <Eigen/Sparse>

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Classes
class	Scine::MolecularMechanics::ScaledInteractions
	This class keeps track which pair-wise interaction between atoms is scaled. The scaling information is stored as a sparse matrix atoms x atoms of booleans. 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.