CDKCIF2SMILES(1)
π CDKCIF2SMILES π
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 π«Ά
β¨ NAME β¨
cdkcif2smiles β convert CIF to SMILES π
πΈ DESCRIPTION πΈ
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. π₯
π USAGE π
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. β¨
π OPTIONS: π
--versionβ prints the program version and dips. that's it, that's the whole thing. π--helpβ prints the short help message (the very message you're looking at, meta ikr) and exits. your bestie when you forget everything. π
ngl, that's the entire page. two options, two usage lines, zero drama. it's giving minimalism and we respect it. π¦
and that's a wrap, babe π this was cdkcif2smiles version 0.4.0, dated February 2026 β go convert some crystals, ily, bye!! πβ¨π
π¦ where this page comes from
- ubuntu resolute: smiles-scripts 0.4.0+dfsg-3 Β· GPL-2.0-only
- ubuntu stonking: smiles-scripts 0.4.0+dfsg-3 Β· GPL-2.0-only
- π girlified by deepseek-ai/DeepSeek-V4.1-Flash on : a language model's rewrite of the original, under its terms