Releases: iktos/rdkit-provider
Releases · iktos/rdkit-provider
v2.7.0
What's Changed
- Feat/expose all molecule descriptors by @RamziWeslati in #71
Full Changelog: v2.6.3...v2.7.0
v2.6.3
What's Changed
- Fix/match substructure only working on exact smiles by @RamziWeslati in #69
Full Changelog: v2.6.2...v2.6.3
v2.6.2
What's Changed
- Fix/simplify get canonical form for structure usage by @RamziWeslati in #68
Full Changelog: v2.6.1...v2.6.2
v2.6.1
What's Changed
- Missing release_molecule and use qmol for getMatchingSubstructure by @atfera in #66
- Fix/seperate qmol and mol caches by @RamziWeslati in #67
Full Changelog: v2.6.0...v2.6.1
v2.6.1-beta.0
chore: v2.6.1-beta.0
v2.6.1-beta.1
Full Changelog: v2.6.0...v.2.6.1-beta.1
v2.7.0-beta.3
Full Changelog: v2.6.0...v2.7.0-beta.3
v2.7.0-beta.2
Full Changelog: v.2.7.0-beta.1...v2.7.0-beta.2
v.2.7.0-beta.1
Full Changelog: v2.6.0-beta.1...v.2.7.0-beta.1
v2.6.0
What's Changed
- chore: update rdkit peer deps by @RamziWeslati in #65
Full Changelog: v.2.5.0...v2.6.0