Searched refs:do_restraint (Results 1 – 4 of 4) sorted by relevance
70 LOGICAL :: do_restraint component265 do_qmmm_periodic_decpl, do_restraint, & local297 CALL section_vals_get(restraint_section, explicit=do_restraint)303 cp_ddapc_ewald%do_restraint = do_restraint .OR. do_restraintB
113 qs_env%cp_ddapc_ewald%do_restraint