`chemistry_tools.pubchem.enums`

Attention

This package has the following additional requirements:

cawdrey>=0.1.7
mathematical>=0.1.13
pillow>=7.0.0
pyparsing>=2.4.6
tabulate>=0.8.9

These can be installed as follows:

python -m pip install chemistry-tools[pubchem]

Enumerations.

Classes:

`CoordinateType`(value)	Enumeration of valid values for the coordinate type.
`PubChemFormats`(value)	Enumeration of supported formats for the PubChem REST API.
`PubChemNamespace`(value)	Enumeration of possible values for the PubChem namespace.

enum CoordinateType(value)[source]

Bases: enum_tools.custom_enums.IntEnum

Enumeration of valid values for the coordinate type.

Member Type: int

Valid values are as follows:

TWO_D = <CoordinateType.TWO_D: 1>

THREE_D = <CoordinateType.THREE_D: 2>

SUBMITTED = <CoordinateType.SUBMITTED: 3>

EXPERIMENTAL = <CoordinateType.EXPERIMENTAL: 4>

COMPUTED = <CoordinateType.COMPUTED: 5>

STANDARDIZED = <CoordinateType.STANDARDIZED: 6>

AUGMENTED = <CoordinateType.AUGMENTED: 7>

ALIGNED = <CoordinateType.ALIGNED: 8>

COMPACT = <CoordinateType.COMPACT: 9>

UNITS_ANGSTROMS = <CoordinateType.UNITS_ANGSTROMS: 10>

UNITS_NANOMETERS = <CoordinateType.UNITS_NANOMETERS: 11>

UNITS_PIXEL = <CoordinateType.UNITS_PIXEL: 12>

UNITS_POINTS = <CoordinateType.UNITS_POINTS: 13>

UNITS_STDBONDS = <CoordinateType.UNITS_STDBONDS: 14>

UNITS_UNKNOWN = <CoordinateType.UNITS_UNKNOWN: 255>

The Enum and its members also have the following methods:

classmethod is_valid_value(value)[source]

Returns whether the value is a valid member of this enum.Enum.

Parameters: value (Any)
Return type: bool

enum PubChemFormats(value)[source]

Bases: enum_tools.custom_enums.StrEnum

Enumeration of supported formats for the PubChem REST API.

Member Type: str

Valid values are as follows:

JSON = <PubChemFormats.JSON: 'JSON'>: JSON Format

XML = <PubChemFormats.XML: 'XML'>: XML Format

CSV = <PubChemFormats.CSV: 'CSV'>: CSV Format

PNG = <PubChemFormats.PNG: 'PNG'>: PNG Format

The Enum and its members also have the following methods:

classmethod is_valid_value(value)[source]

Returns whether the value is a valid member of this enum.Enum.

Parameters: value (Any)
Return type: bool

enum PubChemNamespace(value)[source]

Bases: enum_tools.custom_enums.StrEnum

Enumeration of possible values for the PubChem namespace.

Member Type: str

Valid values are as follows:

CID = <PubChemNamespace.CID: 'cid'>: PubChem Compound ID

Name = <PubChemNamespace.Name: 'name'>: Compound Name

SMILES = <PubChemNamespace.SMILES: 'smiles'>: SMILES String

INCHIKEY = <PubChemNamespace.INCHIKEY: 'inchikey'>: InChI Key

The Enum and its members also have the following methods:

classmethod is_valid_value(value)[source]

Returns whether the value is a valid member of this enum.Enum.

Parameters: value (Any)
Return type: bool

chemistry_tools.pubchem.enums

`chemistry_tools.pubchem.enums`