STORMM Source Documentation
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stormm::energy::LayeredPotentialMetrics Member List

This is the complete list of members for stormm::energy::LayeredPotentialMetrics, including all inherited members.

getBoundaryCondition() conststormm::energy::LayeredPotentialMetrics
getCoulombConstant() conststormm::energy::LayeredPotentialMetrics
getCutoff(int layer_index) conststormm::energy::LayeredPotentialMetrics
getEwaldCoefficient() conststormm::energy::LayeredPotentialMetrics
getExponentFactor(int factor_index, int layer_index=1) conststormm::energy::LayeredPotentialMetrics
getForm() conststormm::energy::LayeredPotentialMetrics
getLayerCount() conststormm::energy::LayeredPotentialMetrics
getMaximumRange() conststormm::energy::LayeredPotentialMetrics
getMixingRule() conststormm::energy::LayeredPotentialMetrics
getRangeCompounding() conststormm::energy::LayeredPotentialMetrics
getUnitCellVectors() conststormm::energy::LayeredPotentialMetrics
getVdwTransitionIntensity() conststormm::energy::LayeredPotentialMetrics
getVdwTransitionMidpoint() conststormm::energy::LayeredPotentialMetrics
LayeredPotentialMetrics(DecomposablePotential form_in=DecomposablePotential::ELECTROSTATIC, BoundaryCondition boundaries_in=BoundaryCondition::ISOLATED, double coulomb_in=amber_ancient_bioq, VdwCombiningRule mixing_rule_in=VdwCombiningRule::GEOMETRIC, const std::vector< double > &exponent_c_in={ 1.0, 1.5, 2.0 }, double particle_particle_cutoff=5.0, double range_multiplier_in=2.0, double range_limit_in=1000.0, double vdw_transition_midpoint_in=hail_default_vdw_xtn_midpoint, double vdw_transition_intensity_in=hail_default_vdw_xtn_intensity, double ewald_coefficient_in=hail_default_ewald_coefficient, const std::vector< double > &box_vectors_in={ 50.0, 0.0, 0.0, 0.0, 50.0, 0.0, 0.0, 0.0, 50.0 })stormm::energy::LayeredPotentialMetrics
LayeredPotentialMetrics(const LayeredPotentialMetrics &original)=defaultstormm::energy::LayeredPotentialMetrics
LayeredPotentialMetrics(LayeredPotentialMetrics &&original)=default (defined in stormm::energy::LayeredPotentialMetrics)stormm::energy::LayeredPotentialMetrics
operator=(const LayeredPotentialMetrics &other)=default (defined in stormm::energy::LayeredPotentialMetrics)stormm::energy::LayeredPotentialMetrics
operator=(LayeredPotentialMetrics &&other)=default (defined in stormm::energy::LayeredPotentialMetrics)stormm::energy::LayeredPotentialMetrics
setBoundaryCondition(BoundaryCondition boundary_in)stormm::energy::LayeredPotentialMetrics
setCoulombConstant(double coulomb_in)stormm::energy::LayeredPotentialMetrics
setCutoff(double cutoff_in)stormm::energy::LayeredPotentialMetrics
setEwaldCoefficient(double ewald_coefficient_in)stormm::energy::LayeredPotentialMetrics
setExponentFactor(int factor_index, double exp_c_in)stormm::energy::LayeredPotentialMetrics
setExponentFactor(const std::vector< double > &exp_c_in) (defined in stormm::energy::LayeredPotentialMetrics)stormm::energy::LayeredPotentialMetrics
setExponentFactor(const double3 exp_c_in) (defined in stormm::energy::LayeredPotentialMetrics)stormm::energy::LayeredPotentialMetrics
setForm(DecomposablePotential form_in)stormm::energy::LayeredPotentialMetrics
setMaximumRange(double range_limit_in)stormm::energy::LayeredPotentialMetrics
setMixingRule(VdwCombiningRule mixing_rule_in)stormm::energy::LayeredPotentialMetrics
setRangeCompounding(double range_multiplier_in)stormm::energy::LayeredPotentialMetrics
setUnitCellVectors(const std::vector< double > &box_vectors_in)stormm::energy::LayeredPotentialMetrics
setVdwTransitionIntensity(double intensity_in)stormm::energy::LayeredPotentialMetrics
setVdwTransitionMidpoint(double midpoint_in)stormm::energy::LayeredPotentialMetrics