cctbx.adp_restraints package

Submodules

• cctbx.adp_restraints.energies module
  • energies
    • energies.adp_similarity_deviation()
    • energies.finalize_target_and_gradients()
    • energies.isotropic_adp_deviation()
    • energies.rigid_bond_deviation()
    • energies.show()
• cctbx.adp_restraints.flags module
  • flags
    • flags.show()

Module contents

class cctbx.adp_restraints.adp_aniso_restraints(xray_structure, restraints_manager, use_hd, selection=None)

Bases: object

class cctbx.adp_restraints.energies_iso(plain_pair_sym_table, xray_structure, parameters, use_u_local_only, use_hd, wilson_b=None, compute_gradients=True, gradients=None, normalization=False, collect=False)

Bases: energies