PNNL researchers learn to control peptoid “handedness,” one key to precision drug delivery and diagnostics.

As new paradigms in advanced computing take shape, computational chemistry researchers are finding new ways to solve challenging chemistry problems.

Converting seawater into hydrogen fuel using electrochemistry offers a renewable energy future for Guam.

PNNL scientists are creating new ways to learn more about the vast sea of chemicals that haven't been identified—yet.

Researchers created the first open-source database of exotic materials eyed for use in quantum applications.

PNNL researchers are studying catalysts that are key to dealing with waste and producing sustainable energy.

Creating films with atomic precision allows researchers moving to the Energy Sciences Center to identify small, but important changes in the materials.

PNNL data scientists are refining their artificial intelligence tools with COVID-19 data to advance therapeutics and treatments for a future pandemic.

Research into practical systems for chemical energy storage will be a focus at the Energy Sciences Center.

Bojana Ginovska leads a physical biosciences research team headed for PNNL's new Energy Sciences Center. She uses the transformative power of molecular catalysis and enzymes to explore scientific principles.

New research aids the design of more efficient water purification technologies.

Marcel Baer is a computational scientist working in PNNL’s Physical Sciences Division with a prominent effort in materials science and physical bioscience.

With quantum chemistry, researchers led by PNNL computational scientist Simone Raugei are discovering how enzymes such as nitrogenase serve as natural catalysts that efficiently break apart molecular bonds to control energy and matter.

Connected moments math shortcut shaves time and cost of quantum calculations while maintaining accuracy.

Today’s critical infrastructure systems are increasingly vulnerable to attacks that could cripple civil society, according to cybersecurity experts.

Pacific Northwest National Laboratory researchers used machine learning to explore the largest water clusters database, identifying—with the most accurate neural network—important information about this life-essential molecule.

PNNL team has developed and implemented a generalizable computational framework to study the resilience of the multilayered London Rail Network to the compound threat of intense flooding and a targeted cyberattack.

PNNL scientists have created a tool called WatchOwl to collect more than 4 million tweets per day related to the COVID-19 pandemic. The tool analyzes tweets related to interventions like social distancing and movement restrictions.

A new book by PNNL biochemist Erick Merkley details forensic proteomics, a technique that directly analyzes proteins in unknown samples, in pursuit of making proteomics a widespread forensic method when DNA is missing or ambiguous.

At a conference featuring the most advanced computing hardware and software, ML in its various guises was on full display and highlighted by Nathan Baker’s featured invited presentation.