MDFactoryMDFactory

BilayerComposition

Define a lipid bilayer composition with z-padding and ionization settings.

Attributes

attributespecieslist[LipidSpecies]
attributez_paddingfloat
= Field(20.0, description='Z-direction box padding above and below the bilayer in A.', ge=0.0)
attributemonolayerbool
= Field(False, description='Whether to just build a monolayer.')
attributeionizationIonizationConfig
= Field(default_factory=IonizationConfig, description='Configuration for ionization.')

Functions

funcvalidate_bilayer(self)BilayerComposition
paramself

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