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D-GRIL: End-to-End Topological Learning with 2-parameter Persistence

2024-06-11 · Soham Mukherjee, Shreyas N. Samaga, Cheng Xin, Steve Oudot, Tamal K. Dey

End-to-end topological learning using 1-parameter persistence is well-known. We show that the framework can be enhanced using 2-parameter persistence by adopting a recently introduced 2-parameter persistence based vectorization technique called GRIL. We establish a theoretical foundation of differentiating GRIL producing D-GRIL. We show that D-GRIL can be used to learn a bifiltration function on standard benchmark graph datasets. Further, we exhibit that this framework can be applied in the context of bio-activity prediction in drug discovery.

📄 PDF Abstract BibTeX arXiv:2406.07100

Code (1)

tda-jyamiti/d-gril 공식 구현 pytorch

Tasks

Activity PredictionDrug Discovery

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