PolyFusionAgent: A Multimodal Foundation Model and Autonomous AI Assistant for P

arXiv:2604.21937v1 Announce Type: new Abstract: Computational drug discovery, particularly the complex workflows of drug molecule screening and optimization, requires

arXiv:2604.08590v1 Announce Type: cross Abstract: We present AlphaLab, an autonomous research harness that leverages frontier LLM agentic capabilities to automate the full

arXiv:2605.13848v1 Announce Type: new Abstract: Agentic LLM frameworks that rely on prompted orchestration, where the model itself determines workflow transitions, often suffer

arXiv:2604.01007v1 Announce Type: new Abstract: AI agents increasingly operate over extended time horizons, yet their ability to retain, organize, and recall multimodal

arXiv:2412.03831v2 Announce Type: cross Abstract: Computing high-dimensional potential energy surfaces for molecular systems and materials is considered to be a great challenge in