tfep.potentials.openmm.OpenMMPotential
======================================

.. currentmodule:: tfep.potentials.openmm

.. autoclass:: OpenMMPotential
   :members:
   :show-inheritance:
   :inherited-members: Module,LightningModule

   
   .. automethod:: __init__

   
   .. rubric:: Methods

   .. autosummary::
   
      ~OpenMMPotential.__init__
      ~OpenMMPotential.add_module
      ~OpenMMPotential.apply
      ~OpenMMPotential.bfloat16
      ~OpenMMPotential.buffers
      ~OpenMMPotential.children
      ~OpenMMPotential.compile
      ~OpenMMPotential.cpu
      ~OpenMMPotential.cuda
      ~OpenMMPotential.default_energy_unit
      ~OpenMMPotential.default_positions_unit
      ~OpenMMPotential.double
      ~OpenMMPotential.eval
      ~OpenMMPotential.extra_repr
      ~OpenMMPotential.float
      ~OpenMMPotential.forward
      ~OpenMMPotential.get_buffer
      ~OpenMMPotential.get_extra_state
      ~OpenMMPotential.get_parameter
      ~OpenMMPotential.get_submodule
      ~OpenMMPotential.half
      ~OpenMMPotential.ipu
      ~OpenMMPotential.load_state_dict
      ~OpenMMPotential.modules
      ~OpenMMPotential.mtia
      ~OpenMMPotential.named_buffers
      ~OpenMMPotential.named_children
      ~OpenMMPotential.named_modules
      ~OpenMMPotential.named_parameters
      ~OpenMMPotential.parameters
      ~OpenMMPotential.register_backward_hook
      ~OpenMMPotential.register_buffer
      ~OpenMMPotential.register_forward_hook
      ~OpenMMPotential.register_forward_pre_hook
      ~OpenMMPotential.register_full_backward_hook
      ~OpenMMPotential.register_full_backward_pre_hook
      ~OpenMMPotential.register_load_state_dict_post_hook
      ~OpenMMPotential.register_load_state_dict_pre_hook
      ~OpenMMPotential.register_module
      ~OpenMMPotential.register_parameter
      ~OpenMMPotential.register_state_dict_post_hook
      ~OpenMMPotential.register_state_dict_pre_hook
      ~OpenMMPotential.requires_grad_
      ~OpenMMPotential.set_extra_state
      ~OpenMMPotential.set_submodule
      ~OpenMMPotential.share_memory
      ~OpenMMPotential.state_dict
      ~OpenMMPotential.to
      ~OpenMMPotential.to_empty
      ~OpenMMPotential.train
      ~OpenMMPotential.type
      ~OpenMMPotential.xpu
      ~OpenMMPotential.zero_grad
   
   

   
   
   .. rubric:: Attributes

   .. autosummary::
   
      ~OpenMMPotential.DEFAULT_ENERGY_UNIT
      ~OpenMMPotential.DEFAULT_POSITIONS_UNIT
      ~OpenMMPotential.T_destination
      ~OpenMMPotential.call_super_init
      ~OpenMMPotential.dump_patches
      ~OpenMMPotential.energy_unit
      ~OpenMMPotential.positions_unit
      ~OpenMMPotential.system
      ~OpenMMPotential.platform
      ~OpenMMPotential.system_name
      ~OpenMMPotential.precompute_gradient
      ~OpenMMPotential.parallelization_strategy
      ~OpenMMPotential.training