CIF_SET_VALUE(1)

📦
version 3.12.0 · 2 versions
, in debian trixie, ubuntu questing, ubuntu resolute, ubuntu stonking

👑 CIF_SET_VALUE 👑

okay bestie, so cif_set_value is a lil command from the General Commands Manual crew, and honestly? it's giving "quiet overachiever" energy. it does one thing and it does it flawlessly. 💅

✨ NAME ✨

cif_set_value — set specified CIF data items to the given values 🎀

like. that's it. that's the whole job. and she ate.

🌸 SYNOPSIS 🌸

cif_set_value --options input1.cif input*.cif

you pass it some options, you pass it a CIF file (or, like, a whole glob of them, no big deal), and she goes to work. 🦋

💖 DESCRIPTION 💖

Set specified CIF data items to the given values.

that's the tea. you tell her which data item, you tell her what value, and she rewrites it inside your CIF file(s). main character behavior fr fr. ✨

💅 OPTIONS 💅

  • -t, --tag _atom_site_occupancy_ — tell her which data item you wanna set. this is literally the "which one" of the operation. 🎯
  • -v, --value _1.0_ — tell her the new value for that data item. the "what" to go with the "which". 🍓
  • --add-tag — if the data item you asked for doesn't exist in a data block yet, she'll add it, with the value you specified. generous queen. 👑
  • --no-add-tag — only overwrite data items that are already there, do not add new ones. this is the default, so if you don't say anything, this is the vibe you get. 🙈
  • --use-perl-parser — pick the Perl parser to parse CIF files. 🧚
  • --use-c-parser — pick the C parser to parse CIF files (default: C parser). ⭐
  • --help, --usage — output a short usage message (this message, bestie, literally this one) and exit. 🌈
  • --version — output version information and exit. 💜

😭 REPORTING BUGS 😭

found a bug? don't be shy, don't suffer in silence — report cif_set_value bugs using e-mail: cod-bugs@ibt.lt 🫶

ngl if something's broken, tell the devs. they wanna know. closed mouths don't get fixed bugs, periodt. 💀

and that's the whole page, bestie! 💖 this one's from the General Commands Manual squad and it's tagged CIF_SET_VALUE(1) — so go forth, set those values, and slay. no cap. 🎀✨🦋

📦 where this page comes from