def setup_restraints(geometry, # restraints_manager verbose=False, ): ba_registry = bond_angle_registry() for angle in geometry.angle_proxies: ba_registry[angle.i_seqs]=angle return ba_registry
def setup_restraints(geometry, verbose=False, ): ba_registry = bond_angle_registry() for angle in geometry.dihedral_proxies: ba_registry[angle.i_seqs]=angle return ba_registry
def setup_restraints( geometry, # restraints_manager verbose=False, ): ba_registry = bond_angle_registry() for angle in geometry.angle_proxies: ba_registry[angle.i_seqs] = angle return ba_registry