Scine::Swoose  2.1.0
This is the SCINE module Swoose.
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Scine::SwooseUtilities::TopologyUtils Member List

This is the complete list of members for Scine::SwooseUtilities::TopologyUtils, including all inherited members.

calculateNumberOfNeighbors(int nAtoms, std::vector< std::list< int >> listsOfNeighbors, std::vector< int > &nNeighbors)Scine::SwooseUtilities::TopologyUtilsstatic
countNeighborsOfElementType(int atomType, const std::vector< std::list< int >> &listsOfNeighbors, Utils::ElementType elementType, const Utils::ElementTypeCollection &elementTypeCollection)Scine::SwooseUtilities::TopologyUtilsstatic
divideStructureAtBond(int a1, int a2, const Utils::BondOrderCollection &bondOrderMatrix, bool &ok)Scine::SwooseUtilities::TopologyUtilsstatic
generateBondOrderMatrixFromListsOfNeighbors(const std::vector< std::list< int >> &listsOfNeighbors)Scine::SwooseUtilities::TopologyUtilsstatic
generateListsOfNeighborsFromBondOrderMatrix(int nAtoms, const Utils::BondOrderCollection &bondOrderMatrix, double minimalBondOrderToConsider)Scine::SwooseUtilities::TopologyUtilsstatic