MLatom 3: Platform for machine learning-enhanced computational chemistry simulations and workflows. - Pavlo O. Dral; Fuchun Ge; Yi-Fan Hou; Peikun Zheng; Yuxinxin Chen; Mario Barbatti; Olexandr Isayev; Cheng Wang; Bao-Xin Xue; Max Pinheiro Jr; Yuming Su; Yiheng Dai; et al. (CoRR, 2023)

All-in-one foundational models learning across quantum chemical levels. - Yuxinxin Chen; Pavlo O. Dral (CoRR, 2024)

Molecular quantum chemical data sets and databases for machine learning potentials. - Arif Ullah; Yuxinxin Chen; Pavlo O. Dral (Mach. Learn. Sci. Technol., 2024)