Data models and query languages are admittedly somewhat dry topics for people who are not in the inner circle of connoisseurs. Although graph data models and query languages are no exception to that ...

Prediction of crystal structures of organic molecules is a critical task in many industries, especially in pharmaceuticals ...

The field of computational materials science has been profoundly transformed by integrating deep learning and other machine learning methodologies. These sophisticated data-driven approaches have ...

Gibaldi and his colleagues have since analysed several open-access MOF databases commonly used for machine learning and found ...