Releases: cheminfo/mass-tools
Releases · cheminfo/mass-tools
v7.40.1
7.40.1 (2024-07-11)
Bug Fixes
- isotopic-distribution: deal correctly with isotopologues in case of non natural isotopic distribution (74684ba)
- mf-parser: getIsotopesInfo set correctly in the atom property the atom and not the isotope or enriched isotope (43f1046)
v7.40.0
7.40.0 (2024-07-08)
Features
- mass-tools: expose function preprocessIonizations (a2cabe8)
Bug Fixes
- enable unicorn ESLint plugin and fix errors (9303048)
- improve types in isotopic-distribution and mf-parser (#202) (e5769cd)
v7.39.0
7.39.0 (2024-06-26)
Features
Bug Fixes
v7.38.0
7.38.0 (2024-06-05)
Features
- MassTools expostes mfFromAtomicRatio (ab787f1)
v7.37.0
7.37.0 (2024-06-05)
Features
- mf-from-atomic-ratio: New package to find f from atomic ratio. Use in XPS for example. (06c1b3e)
v7.36.1
7.36.1 (2024-05-17)
Bug Fixes
- emdb: update dependencies (b4d0e44)
- ms-spectrum: update dependencies in ms-spectrum (3aa0f80)
v7.35.0
7.35.0 (2024-04-16)
Features
- ms-spectrum: Charge is not calcluated on peaks anymore (#184) (2052187)
v7.34.0
7.34.0 (2024-04-03)
Features
- mf-matcher: Add filter by minMW and maxMW for msemMatcher (c46e3b9)