Xie, Mingrou

2 publications

ICLRW 2025 MatDock: Multi-Molecule Docking in Porous Materials with Flow Matching Malte Franke, Mingrou Xie, Akshay Subramanian, Juno Nam, Rafael Gomez-Bombarelli

NeurIPSW 2024 A Chemically-Guided Generative Diffusion Model for Materials Synthesis Planning Elton Pan, Soonhyoung Kwon, Sulin Liu, Mingrou Xie, Yifei Duan, Thorben Prein, Killian Sheriff, Yuriy Roman, Manuel Moliner, Rafael Gomez-Bombarelli, Elsa Olivetti