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![]() Optimal message passing for molecular prediction is simple, attentive and spatialDigital Discovery (DD), 2025 |
![]() Accurate and Scalable Graph Neural Networks via Message InvarianceInternational Conference on Learning Representations (ICLR), 2025 |
![]() A Hybrid Supervised and Self-Supervised Graph Neural Network for Edge-Centric ApplicationsIEEE Transactions on Signal and Information Processing over Networks (TSIPN), 2025 |
![]() Natural Language-Assisted Multi-modal Medication RecommendationInternational Conference on Information and Knowledge Management (CIKM), 2024 |
![]() From Generalist to Specialist: A Survey of Large Language Models for ChemistryInternational Conference on Computational Linguistics (COLING), 2024 |