update

model_cards/article.md

@@ -57,12 +57,16 @@ N.A.
 Model card prototype inspired by [Mitchell et al. (2019)](https://dl.acm.org/doi/abs/10.1145/3287560.3287596?casa_token=XD4eHiE2cRUAAAAA:NL11gMa1hGPOUKTAbtXnbVQBDBbjxwcjGECF_i-WC_3g1aBgU1Hbz_f2b4kI_m1in-w__1ztGeHnwHs)
 
 ## Citation
-TBD, temporarily please cite:
+Please cite:
 ```bib
-@article{manica2022gt4sd,
- title={GT4SD: Generative Toolkit for Scientific Discovery},
- author={Manica, Matteo and Cadow, Joris and Christofidellis, Dimitrios and Dave, Ashish and Born, Jannis and Clarke, Dean and Teukam, Yves Gaetan Nana and Hoffman, Samuel C and Buchan, Matthew and Chenthamarakshan, Vijil and others},
- journal={arXiv preprint arXiv:2207.03928},
- year={2022}
+@article{manica2023accelerating,
+  title={Accelerating material design with the generative toolkit for scientific discovery},
+  author={Manica, Matteo and Born, Jannis and Cadow, Joris and Christofidellis, Dimitrios and Dave, Ashish and Clarke, Dean and Teukam, Yves Gaetan Nana and Giannone, Giorgio and Hoffman, Samuel C and Buchan, Matthew and others},
+  journal={npj Computational Materials},
+  volume={9},
+  number={1},
+  pages={69},
+  year={2023},
+  publisher={Nature Publishing Group UK London}
 }
 ```

requirements.txt

@@ -32,4 +32,5 @@ paccmann_gp @ git+https://github.com/PaccMann/[email protected]
 paccmann_omics @ git+https://github.com/PaccMann/[email protected]
 paccmann_predictor @ git+https://github.com/PaccMann/paccmann_predictor@sarscov2
 reinvent_models @ git+https://github.com/GT4SD/[email protected]
-h11==0.13.0
+h11==0.13.0
+pytorch-lightning==1.7.7