EZBattery Model allows energy storage researchers to more quickly and easily identify the best performing battery designs without the need for extensive physical prototyping or computationally expensive simulations.

A cross-institutional team of scientists developed PeakQC, a new software tool for automated quality control of mass spectrometry data.

A team of researchers from Pacific Northwest National Laboratory and the Environmental Molecular Sciences Laboratory developed a new and flexible software tool called “Advanced Spectra PCA Toolbox.”

Researchers created a methodology to design custom network topologies that improve the execution time for scientific applications.

Researchers unveil user-friendly software to keep complex projects on budget and on schedule.

PNNL researchers present challenges and opportunities for fusing graph neural networks with deep reinforcement learning.

Small teams in the Biological Sciences Division at PNNL and at EMSL—the Environmental and Molecular Sciences Laboratory, an Office of Science user facility at PNNL—are pros at preparation.

PNNL researchers outline open problems in different scientific areas in the Journal of Combinatorics.

Metabolomics analysis revealed differences in metabolome profiles for two distinct modes of fungal wood decay.

Methods review suggests ways to use artificial intelligence and machine learning to handle missing data when integrating two or more omics approaches.

Data-driven autonomous technology to rapidly design and deliver antiviral interventions targeting SARS-CoV-2 to reduce drug discovery timeline and advance bio preparedness capabilities.

Advanced proteomic analysis tools dig deep into human blood plasma to understand the molecular nature of advanced alcoholic disease.

To thwart pathogens, researchers in the epidemiology field of infectious disease (ID) prediction are continuously trying to forecast when, where, and how an ID event will occur.

PNNL joint appointee Auroop Ganguly uses data science to study the impacts of climate change.

A new web-based tool provides easy-to-understand progress metrics and other data about groundwater cleanup sites overseen by the DOE Office of Environmental Management.

SEA-CROGS is one of four Mathematical Multifaceted Integrated Capability Centers selected for support by the Department of Energy.

New research makes molecular-level calculations of water faster and easier.

PNNL researchers teamed up with SambaNova to enhance artificial intelligence for scientific computing.

Researchers use machine learning to speed up the analysis of aerosol datasets from mass spectrometry.

Development of a one-meter path length miniature ion mobility spectrometer based on multilevel structures for lossless ion manipulations.