endstate_correction.protocol.BSSProtocol

class endstate_correction.protocol.BSSProtocol(timestep: int | Quantity, n_integration_steps: int, temperature: float | Quantity, pressure: float | Quantity, report_interval: int, restart_interval: int, rlist: float | Quantity, collision_rate: float | Quantity, switchDistance: float | Quantity, lam: float, restart: bool)[source]

Bases: object

This is a dataclass mimicking the BioSimSpace.Protocol.