possible typos in cifdic.m95 0.7.28

herbert_bernstein (yaya@aip.org)
Sun, 3 Dec 95 22:46:49 EST


The following list was obtained by running a version of cyclops on
cifdic.m95, version 0.7.28, and then hand editing to remove the
data items which clearly were not typos.  What remains are data
items and line numbers which _may_ be typos.  Some of these
were reported earlier by others and some of them may already have
been corrected in the version Paula is working on, but it seemed
prudent to give a few too many, rather than too few.
  -- H. J. Bernstein

Hand edit from:
                    CYCLOPS Check List
of cifdic.m95, 0.7.28


 Data names NOT in Dictionary          Line Numbers

 _atom_sites.cartn_tran_matrix                      3358 30799
*** suggest _atom_sites.cartn_transf_matrix
 _chem_comp.nstd_class                              6016
*** suggest _chem_comp.mon_nstd_class
 _chem_link_bond.value_angle                        7973
*** seems to be missing definition
 _chem_link_bond.value_angle_esd                    7974
*** seems to be missing definition
 _chemical_formula.appendix                         9424
*** perhaps _chemical_formula ????
 _comp.prog.version                                10113
*** perhaps _comp_prog.version
 _comp.prog.citation_id                            10114
*** perhaps _comp_prog.citation_id
 _computing.phasing_mir                            10207 19360
*** can't find this one
 _database.code_pdb                                10377
*** can't find this one
 _diffrn.attenuator_code                           12664
*** perhaps _diffrn_attenuator.code ???
 _entity.name_com.name                             14099
*** suggest _entity_name_com.name
 _exptl.crystal_preparation                        15360
*** perhaps _exptl_crystal.preparation
 _exptl_crystal.face_                              15559
*** perhaps _exptl_crystal_face
 _geom_bond.distance                               17021 30966
*** perhaps _geom_bond.dist
 _computing.phasing_averaging                      18513
*** could not find this one
 _computing.phasing_mad                            18676
*** could not find this one
 _refine.ls_d_res_high                             22623 22639 22660 22703 22734
                                                   22767 22995 23029 23065
*** could not find this one
 _refine.ls_d_res_low                              22623 22639 22660 22704 22735
                                                   22768 22996 23030 23066
*** could not find this one
 _refine.ls_number_reflns                          22820 22869
*** perhaps _refine.ls_number_reflns_obs
 _refine_ls_shell.reflns                           23453 30739
*** perhaps _refine_ls_shell.number_reflns_obs
 _refine.d_res_high                                24333 24338 24344 24347
*** can't find this one
 _refine.d_res_low                                 24334 24339 24345 24348
*** can't find this one
 _reflns_scale_group.code                          24405
*** perhaps _reflns_scale.group_code
 _computing.save_reduction                         24612
*** can't find this one
 _reflns_shell.possible_%_obs                      24987
*** perhaps _reflns_shell.percent_possible_obs
 _struct_site_view_details                         25813 25832 25851 25870 25889
                                                   25908 25927 25946 25965
*** perhaps _struct_site_view
 _struct_mon.details_rscc                          27214 27245 27276 27307 27630
                                                   27661 27692
*** perhaps _struct_mon_details.RSCC
 _struct_mon.details_rsr                           27336 27365 27394 27423 27721
                                                   27749 27777
*** perhaps _struct_mon_details.RSR
 _struct_sheet.number_details                      28429 28459
*** perhaps _struct_sheet.details
 _struct_sheet_range.beg_symmetry                  28889 28914
*** perhaps _struct_sheet_range.symmetry
 _struct_sheet_range.end_symmetry                  28893 28918
*** perhaps _struct_sheet_range.symmetry
 _symmetry.equiv_pos_as_xyz                        29823
*** perhaps _symmetry_equiv.pos_as_xyz