* Added natural language explanation method * Added names to ECFP plots and naming of ECFP fragments
2.1.1
* Fixed bug in `plot_descriptors`
2.1.0
* `plot_descriptors` will no longer save to file without filename
2.0.1
Made default run_stoned argument use basic instead of semantically robust alphabet, as claimed in documentation
2.0.0
* Added surrogate model explanation method * Added support for attributing ECFP, MACCS fingerprints, rdkit descriptors and plotting them * Example notebooks for new method * Fixed chirality stripping in sanitize * Made it possible to use multiple base molecules for ECFP descriptors
2.0.0.dev2
Pre-release 2
- Added surrogate model explanation method - Added support for attributing ECFP, MACCS fingerprints, rdkit descriptors and plotting them - Example notebooks for new method - Fixed chirality stripping in sanitize - Made it possible to use multiple base molecules for ECFP descriptors