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3 changes: 3 additions & 0 deletions README.md
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Expand Up @@ -421,6 +421,9 @@ Rakshit Trivedi, Hanjun Dai, Yichen Wang, Le Song.* ICML 2017 [paper](https://ar
<a name="chemistry" />

### Chemistry
1. **Automatic Generation of Complementary Descriptors with Molecular Graph Networks.**
*Christian Merkwirth and Thomas Lengauer.* J.Chem.Inf.Model. 2005. [paper](https://pubs.acs.org/doi/10.1021/ci049613b)

1. **Molecular Graph Convolutions: Moving Beyond Fingerprints.**
*Steven Kearnes, Kevin McCloskey, Marc Berndl, Vijay Pande, Patrick Riley.* Journal of computer-aided molecular design 2016. [paper](https://arxiv.org/pdf/1603.00856.pdf)

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