Releases: choderalab/mtenn
Releases · choderalab/mtenn
0.5.2
0.5.1
0.5.0
This release modifies the way that mtenn.conversion_utils
models are built so that all can be built by directly passing args for the underlying model. Additionally, we introduce mtenn.config
, which implements Pydantic schema that can be used to reproducibly mtenn
models.
0.4.0
This version implements a major change in the way the GroupedModel and Combination classes are written so that they now work natively in pytorch while also not gobbling all GPU memory. Additionally, all the different types of classes were split into their own files, which will break some API calls.
0.3.0
0.2.1
0.2.0
0.1.0
0.1.0-alpha
Improve packaging - Improve some packaging stuff - Remove versioneer in favour of versiongit - removed old setup.py - setup conda environments - Added install instructions.