emmet.core.molecules.summary

Classes

BondingComposite

Summary information obtained from MoleculeBondingDocs

HasProps

Enum of possible hasprops values.

MetalBindingComposite

Summary information obtained from MetalBindingDocs

MoleculeSummaryDoc

Summary information about molecules and their properties, useful for searching.

MultipolesComposite

Summary information obtained from ElectricMultipoleDocs

OrbitalComposite

Summary information obtained from OrbitalDocs

PartialChargesComposite

Summary information obtained from PartialChargesDocs

PartialSpinsComposite

Summary information obtained from PartialSpinsDocs

RedoxComposite

Summary information obtained from RedoxDocs

TYPE_CHECKING

bool(x) -> bool

ThermoComposite

Summary information obtained from MoleculeThermoDocs

VibrationComposite

Summary information obtained from VibrationDocs

summary_fields

dict() -> new empty dictionary dict(mapping) -> new dictionary initialized from a mapping object's (key, value) pairs dict(iterable) -> new dictionary initialized as if via: d = {} for k, v in iterable: d[k] = v dict(**kwargs) -> new dictionary initialized with the name=value pairs in the keyword argument list. For example: dict(one=1, two=2).