CDKCIF2SMILES(1)

πŸ“¦
version 0.4.0 Β· 4 versions
, in ubuntu resolute, ubuntu stonking

πŸ’– CDKCIF2SMILES πŸ’–

okay bestie, welcome to the cdkcif2smiles page β€” it lives in the User Commands section of the manual, and honestly? it's a little icon doing one very specific job. let's get into it 🫢


✨ NAME ✨

cdkcif2smiles β€” convert CIF to SMILES πŸ’…


🌸 DESCRIPTION 🌸

so what it does is it converts CIFs β€” that's Crystallographic Information Files, for the uninitiated β€” into SMILES. no cap, that's the whole vibe. crystals in, SMILES out. πŸ”₯

πŸŽ€ USAGE πŸŽ€

here's how you actually run it, literally just like this:

cdkcif2smiles < input.cif
cdkcif2smiles inputs*.cif

one file piped in, or a whole lil glob of inputs*.cif at once. pick your fighter. ✨

πŸ’œ OPTIONS: πŸ’œ

  • --version β€” prints the program version and dips. that's it, that's the whole thing. πŸ‘‘
  • --help β€” prints the short help message (the very message you're looking at, meta ikr) and exits. your bestie when you forget everything. πŸ™ˆ

ngl, that's the entire page. two options, two usage lines, zero drama. it's giving minimalism and we respect it. πŸ¦‹

and that's a wrap, babe πŸ’– this was cdkcif2smiles version 0.4.0, dated February 2026 β€” go convert some crystals, ily, bye!! πŸŽ€βœ¨πŸ“

πŸ“¦ where this page comes from