3 papers
cs.AI2026
Scaling-Aware Adapter for Structure-Grounded LLM Reasoning
Zihao Jing, Qiuhao Zeng, Ruiyi Fang +4
Large language models (LLMs) are enabling reasoning over 2D and 3D structures, yet existing methods remain modality-specific and typically compress structural inputs through sequen…
cs.LG2025
Structure-Aware Fusion with Progressive Injection for Multimodal Molecular Representation Learning
Zihao Jing, Yan Sun, Yan Yi Li +3
Multimodal molecular models often suffer from 3D conformer unreliability and modality collapse, limiting their robustness and generalization. We propose MuMo, a structured multimod…
cs.LG2025
MolGraph-xLSTM: A graph-based dual-level xLSTM framework with multi-head mixture-of-experts for enhanced molecular representation and interpretability
Yan Sun, Yutong Lu, Yan Yi Li +3
Predicting molecular properties is essential for drug discovery, and computational methods can greatly enhance this process. Molecular graphs have become a focus for representation…