STORMM Source Documentation
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stormm::structure::MdlMolDataRequest Member List

This is the complete list of members for stormm::structure::MdlMolDataRequest, including all inherited members.

getAtomMask() conststormm::structure::MdlMolDataRequest
getAtomTypes() conststormm::structure::MdlMolDataRequest
getEnergyComponent() conststormm::structure::MdlMolDataRequest
getExternalRegistryNumber() conststormm::structure::MdlMolDataRequest
getKind() conststormm::structure::MdlMolDataRequest
getMaccsFieldNumber() conststormm::structure::MdlMolDataRequest
getMessage() conststormm::structure::MdlMolDataRequest
getSystemLabel() conststormm::structure::MdlMolDataRequest
getTitle() conststormm::structure::MdlMolDataRequest
getValenceParameter() conststormm::structure::MdlMolDataRequest
MdlMolDataRequest(const std::string &title_in=std::string(""), const std::string &label_in=std::string(""))stormm::structure::MdlMolDataRequest
MdlMolDataRequest(const std::string &title_in, StateVariable energy_component_in, const std::string &label_in) (defined in stormm::structure::MdlMolDataRequest)stormm::structure::MdlMolDataRequest
MdlMolDataRequest(DataRequestKind kind_in, const std::string &title_in, const std::string &message_in, const std::string &label_in) (defined in stormm::structure::MdlMolDataRequest)stormm::structure::MdlMolDataRequest
MdlMolDataRequest(const std::string &title_in, StateVariable valence_kind_in, const std::vector< char4 > &atom_types_in, const std::string &label_in) (defined in stormm::structure::MdlMolDataRequest)stormm::structure::MdlMolDataRequest
MdlMolDataRequest(const MdlMolDataRequest &original)=defaultstormm::structure::MdlMolDataRequest
MdlMolDataRequest(MdlMolDataRequest &&original)=default (defined in stormm::structure::MdlMolDataRequest)stormm::structure::MdlMolDataRequest
operator=(const MdlMolDataRequest &other)=default (defined in stormm::structure::MdlMolDataRequest)stormm::structure::MdlMolDataRequest
operator=(MdlMolDataRequest &&other)=default (defined in stormm::structure::MdlMolDataRequest)stormm::structure::MdlMolDataRequest
placeInternalRegistryInHeader() conststormm::structure::MdlMolDataRequest
placeMaccsFieldInHeader() conststormm::structure::MdlMolDataRequest
setExternalRegistryNumber(const std::string &regno_in)stormm::structure::MdlMolDataRequest
setInternalRegistryUsage(const std::string &input)stormm::structure::MdlMolDataRequest
setMaccsFieldNumber(int maccs_in)stormm::structure::MdlMolDataRequest