| K-Paths: Reasoning over Graph Paths for Drug Repurposing and Drug Interaction Prediction | Feb 18, 2025 | Drug DiscoveryKnowledge Graphs | CodeCode Available | 1 |
| Agentic Deep Graph Reasoning Yields Self-Organizing Knowledge Networks | Feb 18, 2025 | graph constructionLarge Language Model | CodeCode Available | 3 |
| Solving Online Resource-Constrained Scheduling for Follow-Up Observation in Astronomy: a Reinforcement Learning Approach | Feb 16, 2025 | AstronomyDeep Reinforcement Learning | —Unverified | 0 |
| DiffMS: Diffusion Generation of Molecules Conditioned on Mass Spectra | Feb 13, 2025 | DecoderDe novo molecule generation from MS/MS spectrum (bonus chemical formulae) | CodeCode Available | 2 |
| LucidAtlas: Learning Uncertainty-Aware, Covariate-Disentangled, Individualized Atlas Representations | Feb 12, 2025 | Additive modelsscientific discovery | —Unverified | 0 |
| NatureLM: Deciphering the Language of Nature for Scientific Discovery | Feb 11, 2025 | Drug DiscoveryRetrosynthesis | —Unverified | 0 |
| Physics-Guided Foundation Model for Scientific Discovery: An Application to Aquatic Science | Feb 10, 2025 | scientific discovery | CodeCode Available | 0 |
| Towards Foundational Models for Dynamical System Reconstruction: Hierarchical Meta-Learning via Mixture of Experts | Feb 7, 2025 | Meta-LearningMixture-of-Experts | —Unverified | 0 |
| Transforming Science with Large Language Models: A Survey on AI-assisted Scientific Discovery, Experimentation, Content Generation, and Evaluation | Feb 7, 2025 | scientific discoverySurvey | CodeCode Available | 1 |
| Safety is Essential for Responsible Open-Ended Systems | Feb 6, 2025 | Positionscientific discovery | —Unverified | 0 |
