v0.1.0

0.1.0 (2026-05-06)

Features

• benchmark of multi candidates (9354487)
• benchmark: results of benchmark (355804c)
• create benchmarking (dee0c77)
• create mol (08206b0)
• dataset for multi candidate benchmark (c6fb12a)
• enable parallel execution of fragmentation tasks (4293f02)
• expose getMoleculeFromIupacCondensed and parseIupacCondensed (a635415)
• get NIST glycan spectra (e771a44)
• get sugar units icons (c906af3)
• parallel fragmentation of glycans standards (6178413)
• parse reference sugar file (d102efa)
• working version of generate molecule fromc omdensed iupac (53d4933)
• write debug JSON per molecule with SVG, trees, JCAMP, and centroids (51a14a1)

Bug Fixes

• rename ionization label to ionization-adduct (399e93c)