Novel generative AI model enables atomic-scale prediction of protein-protein interactions

Proteins are the molecular workhorses of the human body. They perform a vast range of essential functions, from building ...
PBS

Chemistry 301: The Development of the Atomic Theory

The terms theory and model are defined, and students learn how a theory remains valid. Atomic Theory: The Development of the Atomic Theory: The terms theory and model are defined, and students learn ...
Nature

MEPO-ML: a robust graph attention network model for rapid generation of partial atomic charges in metal-organic frameworks

Accurate computation of the gas adsorption properties of MOFs is usually bottlenecked by the DFT calculations required to generate partial atomic charges. Therefore, large virtual screenings of MOFs ...
Business Wire

Atomic AI Creates First Large Language Model Using Chemical Mapping Data to Optimize RNA Therapeutic Development

SOUTH SAN FRANCISCO, Calif.--(BUSINESS WIRE)--Atomic AI, a biotechnology company fusing cutting-edge machine learning with state-of-the-art structural biology to unlock RNA drug discovery, announced ...
Nature

Single-atom level determination of 3-dimensional surface atomic structure via neural network-assisted atomic electron tomography

Functional properties of nanomaterials strongly depend on their surface atomic structures, but they often become largely different from their bulk structures, exhibiting surface reconstructions and ...