Note
This is the last release before a major update. In the next version, we plan to adopt Hydra and PyTorch Lightning, switch to indexing instead of masking and make the networks compatible with TorchScript. Therefore, there will be breaking changes.
New Contributors
* heytitle made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/12
* pankessel made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/14
* bartolsthoorn made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/26
* WardLT made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/38
* RoberTnf made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/40
* FarnazH made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/76
* Dom1L made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/101
* lmj1029123 made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/117
* nzhan made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/158
* jan-janssen made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/164
* dumkar made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/174
* giadefa made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/205
* zyt0y made their first contribution in https://github.com/atomistic-machine-learning/schnetpack/pull/266
**Full Changelog**: https://github.com/atomistic-machine-learning/schnetpack/compare/v0.2.1...v1.0.0