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Advanced Science (Weinheim, Baden-Wurttemberg, Germany)|April 9, 2025
Knowledge Distillation for Molecular Property Prediction: A Scalability AnalysisRahul Sheshanarayana, Fengqi YouJournal of Chemical Information and Modeling|September 26, 2025
Rethinking Retrosynthesis: Curriculum Learning Reshapes Transformer-Based Small-Molecule Reaction PredictionRahul Sheshanarayana, Fengqi YouThe Journal of Chemical Physics|June 1, 2022
Tailoring nanoporous graphene via machine learning: Predicting probabilities and formation times of arbitrary nanopore shapesRahul Sheshanarayana, Ananth Govind RajanApplied Energy|September 20, 2021
Can decontamination and reuse of N95 respirators during COVID-19 pandemic provide energy, environmental, and economic benefits?Yanqiu Tao, Fengqi YouEnvironmental Science & Technology|February 20, 2025
Climate Sustainability through AI-Crypto Synergies and Energy Transition in the Digital Landscape to Cut 0.7 GtCO<sub>2</sub>e by 2030Apoorv Lal, Fengqi YouNature Computational Science|May 9, 2025
Leveraging generative models with periodicity-aware, invertible and invariant representations for crystalline materials designZhilong Wang, Fengqi YouNature Computational Science|February 19, 2026
A dynamic routing-guided interpretable framework for salt-solvent chemistryZhilong Wang, Fengqi YouScience Advances|June 14, 2023
Will reshoring manufacturing of advanced electric vehicle battery support renewable energy transition and climate targets?Apoorv Lal, Fengqi YouProceedings of the National Academy of Sciences of the United States of America|July 10, 2023
Climate concerns and the future of nonfungible tokens: Leveraging environmental benefits of the Ethereum MergeApoorv Lal, Fengqi YouEnvironmental Science & Technology|May 13, 2026
Can Transcontinental Corridors Bridge Climate Sustainability and Energy Security?Apoorv Lal, Fengqi YouPageof 7