FARM: Enhancing Molecular Representations with Functional Group Awareness

Thao Nguyen, Kuan-Hao Huang, Ge Liu, Martin D. Burke, Ying Diao, Heng Ji

Action editor: Christopher Morris

https://openreview.net/forum?id=2All12TFlh

#farm_molecular_representation #moleculenet #molecular

BiScale-GTR: Fragment-Aware graph Transformers for Multi-Scale Molecular Representation Learning

Yi Yang, Ovidiu Daescu

Action editor: Yi Liu

https://openreview.net/forum?id=97L9IRPWu7

#moleculenet #molecular #molecule