occ
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This is the complete list of members for occ::cg::SMDCalculator, including all inherited members.
calculate() | occ::cg::SMDCalculator | |
SMDCalculator(const std::string &basename, const std::vector< occ::core::Molecule > &molecules, const std::vector< occ::qm::Wavefunction > &wavefunctions, const std::string &solvent, const SMDSettings &settings=SMDSettings{}) | occ::cg::SMDCalculator |