Dynamic Linker Distortion in Zr-MOF-808 Driven by Adsorbates: A Machine Learning and Enhanced Sampling Study

Y. Xu, M. Mandal, J. García Sánchez, Y. Jin, G. Roberto Pérez Lemus, M. Delferro, L. Gagliardi, and J. J. de Pablo, Dynamic Linker Distortion in Zr-MOF-808 Driven by Adsorbates: A Machine Learning and Enhanced Sampling Study, J. Mater. Chem. A, 2026. DOI: 10.1039/D6TA02834A