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Argonne Leadership Computing Facility

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Data-Driven Cloud Clustering via a Rotationally Invariant Autoencoder

Publications IEEE Transactions on Geoscience and Remote Sensing

DLHub: Simplifying publication, discovery, and use of machine learning models in science

Publications Journal of Parallel and Distributed Computing

Models and Processes to Extract Drug-like Molecules From Natural Language Text

Publications Frontiers in Molecular Biosciences

Lightweight Function Monitors for Fine-Grained Management in Large Scale Python Applications

Publications 2021 IEEE International Parallel and Distributed Processing Symposium (IPDPS)

Graph-Based Approaches for Predicting Solvation Energy in Multiple Solvents: Open Datasets and Machine Learning Models

Publications The Journal of Physical Chemistry A

2′-O methylation of RNA cap in SARS-CoV-2 captured by serial crystallography

Publications PNAS - Proceedings of the National Academy of Sciences of the United States of America

MemXCT: Design, Optimization, Scaling, and Reproducibility of X-ray Tomography Imaging

Publications IEEE Transactions on Parallel and Distributed Systems ( Early Access )

Permutationally Invariant Polynomial Expansions with Unrestricted Complexity

Publications Journal of Chemical Theory and Computation

Parsimonious Potential Energy Surface Expansions Using Dictionary Learning with Multipass Greedy Selection

Publications The Journal of Physical Chemistry Letters

A Tunable Implementation of Quality-of-Service Classes for HPC Networks

Publications ISC High Performance 2021: International Conference on High Performance Computing

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