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How do Categorical Duplicates Affect ML? A New Benchmark and Empirical AnalysesVraj ShahThomas Parashoset al.2024VLDB 2024
Fragile Earth: Generative and Foundational Models for Sustainable DevelopmentEmre EfteliogluBistra Dilkinaet al.2024KDD 2024
Harnessing negative data for enhancing model learning in chemistryAlessandra ToniatoMara Grazianiet al.2024ACS Fall 2024
AI-Assisted Raman Spectral Peak Label AssignmentAdemir Ferreira Da SilvaMatheus Esteves Ferreiraet al.2024ACS Fall 2024
Atomistic simulations and machine learning approaches to investigate bromoform interactions with cell membranes: Implications for seaweed-based methane emission reductionJie ShiKevin Chenget al.2024ACS Fall 2024
Multimodal Molecular Representation Learning for Small Molecule Drug Discovery - Pretraining and Early Fusion ArchitecturesPartha SuryanarayananShreyans Sethiet al.2024ACS Fall 2024