TY - RPRT TI - ToPolyAgent: AI agents for coarse-grained bead-spring topological polymer simulations AU - Ding, Lijie [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)] (ORCID:0000000227454606) AU - Carrillo, Jan-Michael [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States). Center for Nanophase Materials Sciences (CNMS)] (ORCID:000000018774697X) AU - Do, Changwoo [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)] (ORCID:0000000183588417) PY - 2026 DO - 10.1039/d5dd00471c UR - https://www.osti.gov/biblio/3020907 ID - 3020907 ER -