v0.8.4
What's Changed
- 27 extend to more fingerprints by @c-w-feldmann in #29
- 31 add kwargs to chempropneuralfp init by @c-w-feldmann in #32
- fix rdkit and chemprop to last functioning versions by @c-w-feldmann in #39
- Fix: moltochemprop not compatible with chemprop 2.0.3 by @c-w-feldmann in #37
- Enhance github actions trigger by @c-w-feldmann in #30
- .github: add test coverage with threshold by @JochenSiegWork in #40
- Remove upper bound for RDKit by @c-w-feldmann in #42
- requirements_chemprop.txt: fix stable chemprop version by @JochenSiegWork in #43
- utils/mol2concatinated_vector: changes for xai by @JochenSiegWork in #33
Full Changelog: v0.8.3...v0.8.4