Chemical Data Processing Library C++ API - Version 1.1.1
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Provides default values for built-in control-parameters. More...
Provides default values for built-in control-parameters.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::STRICT_ERROR_CHECKING.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::ORDINARY_HYDROGEN_DEPLETE.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::BOND_MEMBER_SWAP_STEREO_FIX.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::CHECK_LINE_LENGTH.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::JME_SEPARATE_COMPONENTS.
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Default setting (= "\n"
) for the control-parameter Chem::ControlParameter::RECORD_SEPARATOR.
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Default setting (= ""
) for the control-parameter Chem::ControlParameter::INCHI_INPUT_OPTIONS.
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Default setting (= "/WarnOnEmptyStructure /AuxNone /NEWPSOFF"
) for the control-parameter Chem::ControlParameter::INCHI_OUTPUT_OPTIONS.
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Default setting (= 1
) for the control-parameter Chem::ControlParameter::COORDINATES_DIMENSION.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::MDL_IGNORE_PARITY.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::MDL_TRIM_STRINGS.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::MDL_TRIM_LINES.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::MDL_TRUNCATE_STRINGS.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::MDL_TRUNCATE_LINES.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::MDL_UPDATE_TIMESTAMP.
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Default setting (= MDLDataFormatVersion::UNDEF
) for the control-parameter Chem::ControlParameter::MDL_CTAB_VERSION.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::MDL_OUTPUT_CONF_ENERGY_TO_ENERGY_FIELD.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::MDL_OUTPUT_CONF_ENERGY_AS_SD_ENTRY.
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Default setting (= "<Energy>"
) for the control-parameter Chem::ControlParameter::MDL_CONF_ENERGY_SD_TAG.
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Default setting (= MDLDataFormatVersion::UNDEF
) for the control-parameter Chem::ControlParameter::MDL_RXN_FILE_VERSION.
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Default setting (= "S"
) for the control-parameter Chem::ControlParameter::SMILES_RECORD_FORMAT.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::SMILES_WRITE_CANONICAL_FORM.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::SMILES_WRITE_KEKULE_FORM.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::SMILES_WRITE_ATOM_STEREO.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::SMILES_WRITE_BOND_STEREO.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::SMILES_WRITE_RING_BOND_STEREO.
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Default setting (= 8
) for the control-parameter Chem::ControlParameter::SMILES_MIN_STEREO_BOND_RING_SIZE.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::SMILES_WRITE_ISOTOPE.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::SMILES_WRITE_ATOM_MAPPING_ID on reaction SMILES output.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::SMILES_WRITE_ATOM_MAPPING_ID on molecule SMILES output.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::SMILES_WRITE_SINGLE_BONDS.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::SMILES_WRITE_AROMATIC_BONDS.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::SMILES_NO_ORGANIC_SUBSET.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::MULTI_CONF_IMPORT.
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Default setting (= true
) for the control-parameter Chem::ControlParameter::MULTI_CONF_EXPORT.
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Default setting (= pointer to Chem::DefaultMultiConfMoleculeInputProcessor instance) for the control-parameter Chem::ControlParameter::MULTI_CONF_INPUT_PROCESSOR.
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Default setting (= false
) for the control-parameter Chem::ControlParameter::OUTPUT_CONF_ENERGY_AS_COMMENT.
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