TY - RPRT TI - Challenges of conventional iterative all-atom and coarse-grained multiscale molecular dynamics AU - Do, Hung Nguyen [Los Alamos National Laboratory (LANL), Los Alamos, NM (United States)] (ORCID:0000000264974096) AU - McKenzie, Joe [Los Alamos National Laboratory (LANL), Los Alamos, NM (United States)] AU - Gnanakaran, Sandrasegaram [Los Alamos National Laboratory (LANL), Los Alamos, NM (United States)] (ORCID:0000000293683044) PY - 2026 DO - 10.1038/s41598-026-50650-8 UR - https://www.osti.gov/biblio/3375108 ID - 3375108 ER -