When I tell people that I am a modeler, they look at my clothes and general lack of fashion sense and their eyes say, "nuh-uh." When I clarify that I am a multi-scale modeler, I sometimes add, "no I ...

The advancement of heterogeneous catalysis is limited by our understanding of the synergy between the different components of a reaction in progress. Multiscale modelling promises to address the need ...

Molecular modelling of single molecules has become a standard element in the armoury of a chemist, helping to understand many problems in chemical design and synthesis. However, beyond the 'single ...

Surface modification of micro-nanoparticles at the atomic and close-to-atomic scales is of great importance to their applications in a variety of fields, such as energy storage, catalysis, sensors, ...

A new study published in AI Materials presents a comprehensive multi-scale computational framework capable of predicting the mechanical responses of Fe–Cr–Al alloys while incorporating both ...

In a recent article published in the Communications Biology Journal, researchers reviewed epilepsy-related degeneracy at three levels of brain organization: the cellular, network, and systems level.

Patient (pt) experience with a smartphone application (app) and biosensor for remote symptom monitoring during systemic cancer therapy: Qualitative findings from initial testing. This is an ASCO ...

Multiscale modeling has arisen as a focus of computational systems biology, with the realization that genome, proteome, connectome, etceteromes, will only become comprehensible once placed in the ...

The UK's Collaborative Computational Projects for biomolecular and condensed matter simulation, CCPBioSim and CCP5, are holding a third international conference on the theme of multiscale modelling in ...