Weak interactions in CO2 reduction shape catalyst performance, refining computational models and improving predictions for ...

Researchers from the University at Buffalo, Central South University, Shandong Normal University, Sungkyunkwan University, TU ...

Researchers at Kyoto University have developed a machine learning model integrated with neural networks to predict the band ...

Six University of Texas at Austin faculty members were announced today as recipients of Sloan Research Fellowships from the Alfred P. Sloan Foundation, putting UT Austin at the forefront among public ...

The rise of artificial intelligence (AI) has transformed industries like healthcare, transportation, and manufacturing. However, the traditional von Neumann architecture limits computational speed and ...

Georgia Tech Regents’ Professor Srinivas Aluru is the recipient of the Charles Babbage Award for 2025. Aluru was awarded for ...

Computational chemistry describes the use of computer modelling and simulation – including ab initio approaches based on quantum chemistry, and empirical approaches – to study the structures ...

The use of digital twins with industrial, manufacturing and architectural use cases is well known, and in the manifold ...

New research represents a notable step forward in designing enzymes from scratch. With their approach, the authors designed an enzyme that uses a ...

Introduction The manufacturing sector has long been at the forefront of technological adoption, with artificial intelligence ...

Plastic that conducts electricity might sound impossible. But there is a special class of materials known as "electronic ...

This important study characterizes the mechanics and stability of bolalipids from archaeal membranes using molecular dynamics simulations. A mesoscale model of bolalipids is presented and evaluated ...