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Argonne Leadership Computing Facility

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Transfer Learning with Graph Neural Networks for Short-Term Highway Traffic Forecasting

Publications 2020 25th International Conference on Pattern Recognition

Artificial Intelligence-Guided De Novo Molecular Design Targeting COVID-19

Publications ACS Omega

Tuning Parallel Data Compression and I/O for Large-scale Earthquake Simulation

Publications 2021 IEEE International Conference on Big Data (Big Data)

Scheduling Challenges for Variable Capacity Resources

Publications JSSPP 2021

Enabling discovery data science through cross-facility workflows

Publications 2021 IEEE International Conference on Big Data (Big Data)

How Alfven waves energize the solar wind: heat versus work

Publications Journal of Plasma Physics

Data-Driven Wind Turbine Wake Modeling via Probabilistic Machine Learning

Publications Neural Computing and Applications

Dynamical transition orbitals: A particle–hole description in real-time TDDFT dynamics

Publications Journal of Chemical Physics

Nonintuitive Surface Self-Assembly of Functionalized Molecules on Ag(111)

Publications ACS Nano

Computational Campaign on the MTU T161 Cascade

Publications TILDA: Towards Industrial LES/DNS in Aeronautics

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