Scine::Swoose  1.0.0
This is the SCINE module Swoose.
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Scine::MMParametrization::FragmentDataDistributor Member List

This is the complete list of members for Scine::MMParametrization::FragmentDataDistributor, including all inherited members.

FragmentDataDistributor(ParametrizationData &data)Scine::MMParametrization::FragmentDataDistributorexplicit
getCandidateFragments(int fragmentIndex) const Scine::MMParametrization::FragmentDataDistributor
referenceDataIsSufficient(bool refineConnectivity, std::vector< int > failedCalculations={}) const Scine::MMParametrization::FragmentDataDistributor
updateCandidateFragments(int fragmentIndex, std::vector< int > &listOfCandidates) const Scine::MMParametrization::FragmentDataDistributor
updateCandidateFragmentsWithThirdShellNeighbors(int fragmentIndex, std::vector< int > &listOfCandidates) const Scine::MMParametrization::FragmentDataDistributor