Despite being made from a relatively simple set of building blocks, ribonucleic acid (RNA) has a broad array of complex responsibilities. From providing structure to carrying the instructions for ...

Representing a molecule in a way that captures both its structure and function is central to tasks such as molecular property prediction, drug drug interaction prediction, and drug target interaction ...

Scientists have long known that protons hop along hydrogen-bond pathways in these systems. What they couldn't pin down was ...