janus.qmmm.AQMMM
================

.. currentmodule:: janus.qmmm

.. autoclass:: AQMMM

   
   .. automethod:: __init__

   
   .. rubric:: Methods

   .. autosummary::
   
      ~AQMMM.__init__
      ~AQMMM.compute_COM
      ~AQMMM.compute_gradients
      ~AQMMM.compute_lamda_i
      ~AQMMM.compute_zero_energy
      ~AQMMM.convert_input
      ~AQMMM.define_buffer_zone
      ~AQMMM.edit_qm_atoms
      ~AQMMM.electrostatic
      ~AQMMM.find_boundary_bonds
      ~AQMMM.find_buffer_atoms
      ~AQMMM.get_Rmax
      ~AQMMM.get_Rmin
      ~AQMMM.get_buffer_info
      ~AQMMM.get_external_charges
      ~AQMMM.get_forces
      ~AQMMM.get_redistributed_positions
      ~AQMMM.get_zero_energy
      ~AQMMM.make_primary_subsys_trajectory
      ~AQMMM.make_second_subsys_trajectory
      ~AQMMM.mechanical
      ~AQMMM.partition
      ~AQMMM.prepare_link_atom
      ~AQMMM.run_aqmmm
      ~AQMMM.run_qmmm
      ~AQMMM.set_Rmax
      ~AQMMM.set_Rmin
      ~AQMMM.update_traj
   
   

   
   
   .. rubric:: Attributes

   .. autosummary::
   
      ~AQMMM.nm_to_angstrom