PNNL researchers have published their paper “Introducing Molecular Hypernetworks for Discovery in Multidimensional Metabolomics Data” in the Journal of Proteome Research.

A new study led by PNNL researcher TC Chakraborty provides some answers about how irrigated agricultural land near cities affects urban heat stress.

Researchers can now quantify uncertainty in trained AI models aimed at solving difficult chemistry, biology and materials science problems.

Researchers have created an algorithm that slashes the calculations necessary to prepare and customize data for quantum computing.

Over the next four years, PNNL and University of Arizona will develop open-source computational tools to better identify and characterize the viruses associated with the human microbiome.

Armed with some of the world’s most advanced instrumentation, researchers at PNNL are working to analyze huge amounts of data and uncover hidden biological connections.

Scientists are exploring how web search engine technology might also keep the lights on, the water running and the trains moving.

A potential quantum advantage for fluid dynamics simulations from molecular to atmospheric scales with a new formula for success.

CACTUS provides AI-powered cheminformatics for autonomous science.

New datasets delineating global urban land support scientific research, application, and policy, but they can produce different results when applied to the same problem making it difficult for researchers to decide which to use.

Knowing future snow levels is key for managing the recovery of endangered bighorn sheep. PNNL scientists help to forecast how the sheep could fare.

A new study reveals just how costly Earth's tipping points can be.

Scientists are using artificial intelligence and powerful computing to sculpt new molecules in an effort to treat disease.

The demand for energy is growing—and so is the technology supporting it. However, future development of power generation technologies could be affected by a key factor: material supply.

University of Washington Professor David Baker won the 2024 Nobel Prize in Chemistry for computational protein design.

A team of researchers at PNNL is developing a new approach to explore the higher-dimensional shape of cyber systems to identify signatures of adversarial attacks.

Mengqi Zhao and Chris Vernon were selected to serve in editorial roles at JOSS for Earth science and data science, respectively.

Scientists plumbed the depths of nearly 3,000 soil samples from around the globe to compile the heftiest atlas of soil viruses ever created.

The Delaware River Basin is projected to experience a regional increase in flood severity under future climate scenarios.

The Department of Energy’s Vehicle Technologies Office recognized Livewire’s outstanding teamwork and technical expertise.