A team from the Institute for Molecular Recognition and Technological Development (IDM) at the Universitat Politècnica de València (UPV) and the University of Oxford have developed new software that, ...

A graphics supercomputer that for the first time combines high-speed computation, three-dimensional graphics, and molecular modeling and simulation software in a single interactive system was ...

Siemens announces that it has signed an agreement to acquire Culgi, a computational chemistry software company with a focus on multiscale simulations in the process industries. Culgi will join Siemens ...

More than 20% of the workload on the world's 500 fastest supercomputers is spent simulating how atoms and molecules move—with applications ranging from material design to identifying drug interactions ...