Core

schemas.workflow.amber.v18.core.Amber18Schema

Bases: AmberSchemaBase

Amber 18 schema for simulation contexts.

cli = Field(default_factory=Amber18CLI) class-attribute instance-attribute

ff = Field(default_factory=Amber18Forcefield) class-attribute instance-attribute

inputs = Field(default_factory=Amber18Inputs) class-attribute instance-attribute