Parallel graph neural networks identify protein-ligand 3-D structural interactions to aid in protein function prediction and drug discovery.

Mowei Zhou, a chemist with the Environmental Molecular Sciences Laboratory, is speaking at the ACS spring conference on his latest protein discoveries for a plant that could transform biofuels production.

Vanda Glezakou and Laboratory Fellow Roger Rousseau collaborated with other experts to write an American Chemical Society book chapter.

A hybrid computing approach for solving quantum chemical problems offers a practical bridge between classical and quantum computing.

The U.S. Department of Energy has selected the Scalable Predictive Methods for Excitations and Correlated Phenomena project to receive funding to develop software for chemical research.

PNNL chemical biologist Aaron Wright discusses molecular profiling of the gut microbiome.

This committee represents the country’s soil science community in the International Union of Soil Sciences, advises The National Academies, and communicates with professional societies and organizations.

The project received an Innovative and Novel Computational Impact on Theory and Experiment (INCITE) award, a highly competitive U.S. Department of Energy Office of Science program.

The PNNL chemist is leading a joint effort to study circadian rhythms and the gut microbiome.