Releases: iktos/rdkit-provider
Releases · iktos/rdkit-provider
v2.9.1
v2.9.0
What's Changed
- Feat/get morgan fp by @RamziWeslati in #73
- move @rdkit/rdkit to dependencies
- chore(types): expose all output types
Full Changelog: v2.8.0...v2.9.0
v2.9.0-beta.0
chore: v2.9.0-beta.0
v2.8.0
What's Changed
- feat(worker): add isChiral smiles by @RamziWeslati in #72 (Requires "@rdkit/rdkit": "^2024.3.5-1.0.0")
Full Changelog: v2.7.0...v2.8.0
v2.8.0-beta.0
chore(license): allow Apache-2.0
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