Molecular Fingerprints Remain an Important Representation of Small Molecules for Biochemistry

ICLR 2025 Workshop LMRL Submission106 Authors

13 Feb 2025 (modified: 18 Apr 2025)Submitted to ICLR 2025 Workshop LMRLEveryoneRevisionsBibTeXCC BY 4.0
Track: Tiny Paper Track
Keywords: molecular fingerprints, graph neural networks, drug--drug interactions (DDIs)
TL;DR: Molecular fingerprints are still relevant for tasks that are biochemical in nature
Abstract: N/A (tiny paper)
Submission Number: 106
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