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Investigate and prepare a short report on AttentiveFP (Attentive Fingerprint) and its application to cheminformatics

Open mkviatkovskii opened this issue 3 years ago • 0 comments

Prepare a short report (for about 10-20 minutes) and short presentation about key idea of message passing neural networks and their application to cheminformatics.

Recommended sources:

  • https://www.researchgate.net/publication/335156258_Pushing_the_boundaries_of_molecular_representation_for_drug_discovery_with_graph_attention_mechanism

mkviatkovskii avatar Jan 10 '22 10:01 mkviatkovskii