EulerMaruyamaRigidBody ---------------------- The EulerMaruyamaRigidBody integrator extends the Euler-Maruyama method to simulate rigid body Brownian dynamics [Delong2015]_ in the NVT ensemble, including both translational and rotational motion. ---- * **type**: ``Brownian``, ``EulerMaruyamaRigidBody`` * **parameters**: * ``timeStep``: ``real``: Time step :math:`[time]` * ``temperature``: ``real``: Temperature of the system :math:`[energy]` * ``viscosity``: ``real``: Viscosity of the implicit solvent :math:`[mass/(distance \cdot time)]` (optional if translational and rotational self-diffusion are defined in particle data) Example: .. code-block:: "eulerMaruyamaRigidBody":{ "type":["Brownian","EulerMaruyamaRigidBody"], "parameters":{ "timeStep": 0.01, "temperature": 1.0, "viscosity": 1.0 } } .. note:: If ``viscosity`` is provided, the integrator will compute both translational and rotational self-diffusion coefficients for each particle based on their radii. .. warning:: This integrator assumes that particle masses, radii, and orientations (as quaternions) are defined in the particle data. .. [Delong2015] Delong, Steven, Florencio Balboa Usabiaga, and Aleksandar Donev. "Brownian dynamics of confined rigid bodies." The Journal of chemical physics 143, no. 14 (2015).