International Tables for Crystallography (2006). Vol. G. ch. 2.4, pp. 44-52
https://doi.org/10.1107/97809553602060000730 |
Chapter 2.4. Specification of the Molecular Information File (MIF)
Chapter index
absolute configuration 2.4.8
American Society for Testing and Materials 2.4.2
ASCII 2.4.4
block code 2.4.4.4
bonding conventions (MIF) 2.4.6
bond properties
MIF 2.4.4.2
Chemical Abstracts Service 2.4.2
chemical entity
MIF description 2.4.4
chemical graph (MIF) 2.4.1
Chemical Structure Association 2.4.2
colour
atom and bond representations (MIF) 2.4.5
comment 2.4.4.2
conformational representation, using save frame (MIF) 2.4.4.3
database
query language 2.4.9
DDL 2.4.5
DDL1 (Dictionary Definition Language)
_category 2.4.5
_enumeration 2.4.9
_enumeration_range 2.4.9
_list 2.4.4.2
_type_conditions 2.4.9
DDL1
use in MIF 2.4.4
enantiomer 2.4.8
extensibility 2.4.10
frame code 2.4.4.3
global_ (STAR File keyword) 2.4.4.5
graph theory (chemical structure) 2.4.1
IUCr 2.4.2
line length
MIF 2.4.4
loop_ (STAR File keyword) 2.4.4.2
loop packet 2.4.4.2
MIF (Molecular Information File)
_atom_charge 2.4.7
_atom_cip 2.4.8
_atom_coord_x 2.4.5
_atom_coord_y 2.4.5
_atom_coord_z 2.4.5
_atom_environment 2.4.7
_atom_frag_id 2.4.7
_atom_frag_key 2.4.7
_atom_label 2.4.5
_atom_type 2.4.5
_bond_cip 2.4.8
_bond_type_casreg3 2.4.6
_bond_type_ccdc 2.4.6
_display_conn_colour 2.4.5
_display_conn_id 2.4.5
_display_conn_symbol 2.4.5
_display_define_origin 2.4.5
_display_object 2.4.5
_display_size 2.4.5
_stereo_atom_id 2.4.8
_stereo_bond_id_1 2.4.8
_stereo_bond_id_2 2.4.8
_stereo_vertex_id 2.4.8
molecular fragment
represented by save frame (MIF) 2.4.4.3
molecule
MIF description 2.4.4
ontology 2.4.10
query language
MIF 2.4.9
quoted text string 2.4.4.1
racemic mixture 2.4.8
redundancy 2.4.6
save_ (STAR File keyword) 2.4.4.3
scope 2.4.4.5
text string 2.4.4.1
topology (chemical structure) 2.4.2
universal data language 2.4.1
web sites
SMILES format: http://www.daylight.com/smiles/ 2.4.10
Working Party on Crystallographic Information 2.4.2