Theory, computation, and simulation are foundational to modern energy research. Theoretical understanding reveals why materials and systems behave as they do, predicting performance before experiments ...

Computational Modelling and Simulation (CM&S) is a powerful tool. When applied well, with the right questions and inputs, it ...

The new model developed by Flatiron Institute researchers proposes that biological neurons have more control over their surroundings than previously thought, something that could be replicated in the ...

Researchers developed a way to quickly calculate the transition state structure of a chemical reaction, using machine-learning models. During a chemical reaction, molecules gain energy until they ...

Cognitive computational neuroscience has entered a transformative era. The rapid rise of large multimodal foundation models, state-space architectures, and ...

In the same vein as weather forecast models that predict developing storms, researchers have now developed a method to predict the cell activity in tissues over time. The new software combines ...

The University of Chicago announced this week the formation of the first U.S.-based node of the Centre Européen de Calcul Atomique and Moléculaire (European Centre for Atomic and Molecular Computation ...

In recent years, the frequency of weather-related natural disasters—cyclones, torrential rains, floods—has increased as a consequence of global warming. These disasters cause billions of dollars in ...

This article explores how new approach methodologies are transforming drug discovery through human-relevant models, including ...

Had you queried DeepSeek, a Chinese AI, however, you would have got quite different advice. “Seek compromise,” it suggests, ...