Scine::Swoose  2.1.0
This is the SCINE module Swoose.
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Scine::MolecularMechanics::DispersionTerm Member List

This is the complete list of members for Scine::MolecularMechanics::DispersionTerm, including all inherited members.

AtomIndex typedef (defined in Scine::MolecularMechanics::DispersionTerm)Scine::MolecularMechanics::DispersionTerm
disable()Scine::MolecularMechanics::InteractionTermBaseinline
disabled_ (defined in Scine::MolecularMechanics::InteractionTermBase)Scine::MolecularMechanics::InteractionTermBaseprotected
DispersionTerm(AtomIndex firstAtom, AtomIndex secondAtom, const Dispersion &dispersion, std::shared_ptr< double > cutoffRadius)Scine::MolecularMechanics::DispersionTerm
enable()Scine::MolecularMechanics::InteractionTermBaseinline
evaluateDispersionTerm(const std::vector< Utils::Dftd3::Dftd3Atom > &structureOfDftd3Atoms, Utils::FullSecondDerivativeCollection &derivatives, std::shared_ptr< Utils::Dftd3::Dftd3 > d3, Eigen::MatrixXd &R0) const Scine::MolecularMechanics::DispersionTerm
getDispersion() const Scine::MolecularMechanics::DispersionTerm
getFirstAtom() const Scine::MolecularMechanics::DispersionTerm
getSecondAtom() const Scine::MolecularMechanics::DispersionTerm
~DispersionTerm()Scine::MolecularMechanics::DispersionTerm