arxivcs.LG2026-07-31
UniPolymer: A Unified Framework for Property Prediction, Structure Recommendation, and Evaluation in Polyimide Design
Junquan Hu, Zhihui Wang, Peng Xu, Xinru Guo, Xintong Li, Kun Lu, et al.
Designing polyimide structures with specific glass transition temperatures (Tg) is highly challenging. Existing methods primarily focus on target-conditioned generation, lacking an assessment of the consistency between the generated structure and the target properties. This leads…