Open-source software unlocks rapid DNA structure generation and analysis in one workflow

Computational chemists at the University of Amsterdam's Van 't Hoff Institute for Molecular Sciences have developed a comprehensive software suite to create accurate models of DNA in biomolecular ...
Nature

Classification of apatite structures via topological data analysis: a framework for a ‘Materials Barcode’ representation of structure maps

One of the classic questions in materials crystal chemistry is: why do atoms arrange themselves in the way they do? To address this challenge, the concept of phase homologies has been widely used.

Visualizing band structures in nanostructures: Extending band theory to imperfect periodic and bent systems

An international collaborative research group has developed a new computational method to visualize the electronic states of ...
Nature

Nonlinear Inelastic Analysis of Steel Frame Structures

Nonlinear inelastic analysis of steel frame structures addresses responses beyond the elastic limit, capturing material yielding, large deformations and stability phenomena under service and extreme ...