CIF_AUTOMORPHISM(1)
π cif_automorphism π
okay so bestie, this is the cif_automorphism manual page, section 1 of the General Commands Manual, and it's literally here to help you find automorphism orbits in CIF files. yes. that's the whole vibe. let's get into it π¦
β¨ NAME β¨
cif_automorphism β find automorphism orbits in CIF files.
πΈ SYNOPSIS πΈ
π DESCRIPTION π
Find automorphism orbits in CIF files. that's it, that's the mission. you hand it CIF files, it finds the automorphism orbits. main character energy fr fr π
π OPTIONS π
--ignore-hydrogensβ do NOT consider hydrogen atoms when it's doing automorphism detection. bye hydrogens π--no-ignore-hydrogensβ take hydrogen atoms into consideration when searching for automorphisms. this one is the default, so if you don't say anything, the hydrogens are invited to the party π--print-atom-site-type-symbolβ output the assumed atom chemical types as the values of'_atom_site_type_symbol', but only if this data item isn't already being used. like, if the slot's free, it fills it in β¨--no-print-atom-site-type-symbolβ do NOT output assumed atom chemical types as values of'_atom_site_type_symbol'. this is the default π--use-c-parserβ use the Perl & C parser for CIF parsing. this is the default π₯--use-perl-parserβ use the Perl parser for CIF parsing. the other option, for when you're feeling different π--help,--usageβ output a short usage message (this message, the one you're reading the vibe of) and then exit. peace out βοΈ--versionβ output version information and exit. tell me who you are and then leave π
π REPORTING BUGS π
found a bug in cif_automorphism? don't be shy, report it using e-mail: cod-bugs@ibt.lt π«Ά they wanna hear it, no cap.
okay bestie that's the whole page π every flag, every default, every '_atom_site_type_symbol', all of it β nothing skipped, nothing invented.
and that's a wrap on this lil slice of the General Commands Manual, page CIF_AUTOMORPHISM(1) β go find those automorphism orbits, you've got this π§πΈβ
π¦ where this page comes from
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