tfep.potentials.psi4.Psi4Potential
==================================

.. currentmodule:: tfep.potentials.psi4

.. autoclass:: Psi4Potential
   :members:
   :show-inheritance:
   :inherited-members: Module,LightningModule

   
   .. automethod:: __init__

   
   .. rubric:: Methods

   .. autosummary::
   
      ~Psi4Potential.__init__
      ~Psi4Potential.add_module
      ~Psi4Potential.apply
      ~Psi4Potential.bfloat16
      ~Psi4Potential.buffers
      ~Psi4Potential.children
      ~Psi4Potential.compile
      ~Psi4Potential.cpu
      ~Psi4Potential.cuda
      ~Psi4Potential.default_energy_unit
      ~Psi4Potential.default_positions_unit
      ~Psi4Potential.double
      ~Psi4Potential.energy
      ~Psi4Potential.eval
      ~Psi4Potential.extra_repr
      ~Psi4Potential.float
      ~Psi4Potential.force
      ~Psi4Potential.forward
      ~Psi4Potential.get_buffer
      ~Psi4Potential.get_extra_state
      ~Psi4Potential.get_parameter
      ~Psi4Potential.get_submodule
      ~Psi4Potential.half
      ~Psi4Potential.ipu
      ~Psi4Potential.load_state_dict
      ~Psi4Potential.modules
      ~Psi4Potential.mtia
      ~Psi4Potential.named_buffers
      ~Psi4Potential.named_children
      ~Psi4Potential.named_modules
      ~Psi4Potential.named_parameters
      ~Psi4Potential.parameters
      ~Psi4Potential.register_backward_hook
      ~Psi4Potential.register_buffer
      ~Psi4Potential.register_forward_hook
      ~Psi4Potential.register_forward_pre_hook
      ~Psi4Potential.register_full_backward_hook
      ~Psi4Potential.register_full_backward_pre_hook
      ~Psi4Potential.register_load_state_dict_post_hook
      ~Psi4Potential.register_load_state_dict_pre_hook
      ~Psi4Potential.register_module
      ~Psi4Potential.register_parameter
      ~Psi4Potential.register_state_dict_post_hook
      ~Psi4Potential.register_state_dict_pre_hook
      ~Psi4Potential.requires_grad_
      ~Psi4Potential.set_extra_state
      ~Psi4Potential.set_submodule
      ~Psi4Potential.share_memory
      ~Psi4Potential.state_dict
      ~Psi4Potential.to
      ~Psi4Potential.to_empty
      ~Psi4Potential.train
      ~Psi4Potential.type
      ~Psi4Potential.xpu
      ~Psi4Potential.zero_grad
   
   

   
   
   .. rubric:: Attributes

   .. autosummary::
   
      ~Psi4Potential.DEFAULT_ENERGY_UNIT
      ~Psi4Potential.DEFAULT_POSITIONS_UNIT
      ~Psi4Potential.T_destination
      ~Psi4Potential.call_super_init
      ~Psi4Potential.dump_patches
      ~Psi4Potential.energy_unit
      ~Psi4Potential.positions_unit
      ~Psi4Potential.training