Releases: matchms/ms2deepscore
Releases · matchms/ms2deepscore
2.7.1 (bug fix)
2.7.0
What's Changed
- Update tutorial by @niekdejonge in #283
- Fix data split by @niekdejonge in #277
- Balance across ionmodes by @niekdejonge in #278
- Added macos-14 (M1 chip) to CI-Build by @niekdejonge in #221
- Add embedding evaluator training to training wrapper by @niekdejonge in #284
Full Changelog: 2.6.0...2.7.0
2.6.0
What's Changed
- Refactor load_model to use factories for settings and model by @florian-huber in #281
- Added notebook for creating supplementary information section 11 by @niekdejonge in #282
- Pytorch update by @florian-huber in #280
Full Changelog: 2.5.5...2.6.0
2.5.5
What's Changed
- remove unused torchvision and update sonarqube pipeline by @florian-huber in #279
Full Changelog: 2.5.4...2.5.5
2.5.4
What's Changed
- Update revisions by @niekdejonge in #275
- add progress bar to embedding computations by @florian-huber in #276
Full Changelog: 2.5.3...2.5.4
2.5.3
What's Changed
- Remove monte carlo since not supported for current models by @niekdejonge in #271
- Update minimum matchms version in setup.py by @niekdejonge in #274
- Update revisions by @niekdejonge in #273
Full Changelog: 2.5.2...2.5.3
2.5.2
What's Changed
- Update tutorials by @niekdejonge in #266
- move to numpy >=2 by @florian-huber in #268
Full Changelog: 2.5.1...2.5.2
2.5.1
What's Changed
- Alternative remove_diagonal implementation by @florian-huber in #264
- restrict torch until new model load/save is implemented by @florian-huber in #265
Full Changelog: 2.5.0...2.5.1
2.5.0
What's Changed
- Remove outdated notebooks and update notebooks for ms2deepscore 2 by @niekdejonge in #238
- Add notebook for optimizing sampling algorithm by @niekdejonge in #256
- Added saving history as json file (instead of only plotting) by @niekdejonge in #257
- Add notebook hyperparemeter optimization by @niekdejonge in #258
- Add notebooks benchmarking by @niekdejonge in #259
- Add notebooks benchmarking by @niekdejonge in #261
- Added notebook for comparison with modified cosine scores by @niekdejonge in #262
- Add notebooks analyzing the case studies by @niekdejonge in #255
Full Changelog: 2.4.0...2.5.0