PeriodicBoundaries.h File Reference

Extras for dealing with periodic boundaries. More...

#include "Molassembler/Types.h"
#include <vector>
#include <unordered_set>
#include <unordered_map>

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Data Structures
struct	Scine::Molassembler::PeriodicBoundaryDuplicates
struct	Scine::Molassembler::SubstitutionsGenerator

Namespaces
	Scine::Molassembler
	Central library namespace.

Detailed Description

Extras for dealing with periodic boundaries.

Copyright

This code is licensed under the 3-clause BSD license. Copyright ETH Zurich, Laboratory of Physical Chemistry, Reiher Group. See LICENSE.txt for details.