TY  - RPRT
TI  - EvoDiffMol: evolutionary diffusion framework for 3D molecular design with optimized properties
AU  - Lin, Xiaobo [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)] (ORCID:0000000321086168)
AU  - Kearney, Logan T. [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)] (ORCID:0000000308113483)
AU  - Su, Zhaoqian [Takeda Pharmaceutical Company Ltd., Cambridge, MA (United States)]
AU  - Liu, Yunchao [Broad Institute of MIT and Harvard, Cambridge, MA (United States)]
AU  - Naskar, Amit K. [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)] (ORCID:0000000210940325)
AU  - Bhowmik, Debsindhu [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)] (ORCID:0000000177709091)
PY  - 2026
DO  - 10.1186/s13321-026-01237-y
UR  - https://www.osti.gov/biblio/3395427
ID  - 3395427
ER  -