Fig. 5: Prediction of high TC polymers in PoLyInfo and PI1M databases using constructed ML models.

a, b and c based on RF, XGBoost, and MLP models, respectively. d Synthetic accessibility (SA) score versus calculated log₂TC of screened high TC polymers (TC > 20.00 W m⁻¹K⁻¹). The star indicates PE, and the TC in this work is 38.98 W m⁻¹K⁻¹.