Scaling LLM Planning: NL2FLOW for Parametric Problem Generation and Rigorous EvaluationJung koo Kang2025NeurIPS 2025
When Data is the Algorithm: A Systematic Study and Curation of Preference Optimization DatasetsAladin DjuheraFarhan Ahmedet al.2025NeurIPS 2025
Pareto-Guided Reinforcement Learning for Multi-Objective ADMET Optimization in Generative Drug DesignHoang-my NguyenNguyet Hang Vuet al.2025NeurIPS 2025
A Large Multimodal Molecular Representation Encoder-Decoder Foundation Model for ChemistryVictor Yukio ShirasunaEmilio Ashton Vital Brazilet al.2025NeurIPS 2025
Emergent SO(3)-Invariant Molecular Representations from Multimodal AlignmentEduardo Almeida SoaresVictor Yukio Shirasunaet al.2025NeurIPS 2025
Token-Level Early Fusion Model Bridging Text and 3D Electron Density Grids in ChemistryEduardo Almeida SoaresEmilio Ashton Vital Brazilet al.2025NeurIPS 2025
Representation Similarity Reveals Implicit Layer Grouping in Neural NetworksTian GaoAmit Dhurandharet al.2025NeurIPS 2025
Geospatial Chain of Thought Reasoning for Enhanced Visual Question Answering on Satellite ImageryShambhavi ShankerManikandan Padmanabanet al.2025NeurIPS 2025