openff.interchange.components.base.BaseElectrostaticsHandler

pydantic model openff.interchange.components.base.BaseElectrostaticsHandler[source]

Base handler for storing vdW interactions.

Config

arbitrary_types_allowed: bool = True
json_encoders: dict = {<class ‘openff.units.units.Quantity’>: <function custom_quantity_encoder at 0x7fdff3466f70>}
json_loads: function = <function json_loader at 0x7fdff3459280>
validate_assignment: bool = True

Fields

expression (str)
method (Literal['pme', 'cutoff', 'reaction-field', 'no-cutoff'])
type (str)

field type: str = 'Electrostatics'

field expression: str = 'coul'

field method: Literal['pme', 'cutoff', 'reaction-field', 'no-cutoff'] = 'pme'

property charges: Get the total partial charge on each atom, excluding virtual sites.