diff --git a/paper/paper.md b/paper/paper.md index 32b5b550..ca6c1107 100644 --- a/paper/paper.md +++ b/paper/paper.md @@ -27,22 +27,32 @@ TODO TODO -# Key references +# Related work `graph-pes` is driving a significant number of projects within the Deringer group, and has already been cited in @Liu-24-12. -The core functionality of `graph-pes` builds upon the - - `PyTorch` [@Paszke-19] - - `ase` [@HjorthLarsen-17-06] +The core functionality of `graph-pes` builds upon + +- `PyTorch` [@Paszke-19] + +- `ase` [@HjorthLarsen-17-06] + `graph-pes` also builds upon the `e3nn` [@Geiger-22-07] package for implementing the `NequIP` [@Batzner-22-05] and `MACE` [@Batatia-23-01] architectures. Other note-worthy softwares that offer similar functionality to `graph-pes` include: + - `nequip` + - `mace-torch` + - `deepmd` + - `schnetpack` + - `torchmd` # Acknowledgements Krystian Gierczak, Daniel Thomas du Toit and ZoƩ Faure Beaulieu for early testing and feedback. + +# References \ No newline at end of file