Polymer informatics with multi-task learning. - Christopher Künneth; Arunkumar Chitteth Rajan; Huan Tran; Lihua Chen; Chiho Kim; Rampi Ramprasad (Patterns, 2021)

Accelerating quantum molecular simulations. - Huan Tran (Nat. Comput. Sci., 2022)

May the Force be with You: Unified Force-Centric Pre-Training for 3D Molecular Conformations. - Rui Feng; Qi Zhu; Huan Tran; Binghong Chen; Aubrey Toland; Rampi Ramprasad; Chao Zhang (NeurIPS, 2023)

PolyGET: Accelerating Polymer Simulations by Accurate and Generalizable Forcefield with Equivariant Transformer. - Rui Feng; Huan Tran; Aubrey Toland; Binghong Chen; Qi Zhu; Rampi Ramprasad; Chao Zhang (CoRR, 2023)