Computational Chemistry is the study of complex chemical problems using a combination of computer simulations, chemistry theory and information science. Also called cheminformatics, this field enables ...

A team of physicists has developed a groundbreaking method for detecting congestive heart failure with greater ease and precision than previously thought possible. This multidisciplinary study, ...

Future events such as the weather or satellite trajectories are computed in tiny time steps, so the computation must be both efficient and as accurate as possible at each step lest errors pile up. A ...

Computational fluid dynamics (CFD) is a branch of physics that utilizes numerical methods and algorithms to analyze and predict the behavior of fluids and gases under various conditions. This field ...

A new computational method can identify how cause-and-effect relationships ebb and flow over time in dynamic real-life systems such as the brain. The method was reported today in a Reviewed Preprint ...

When scientists sequence tumor DNA, they typically find small amounts of genetic code from bacteria, viruses and fungi – microorganisms that, if actually present in tumor tissues, could influence how ...

The new method can determine crystal structures underlying experimental data thus far difficult to analyze. A joint research team led by Yuuki Kubo and Shiji Tsuneyuki of the University of Tokyo has ...

Scientists at La Jolla Institute for Immunology (LJI) have developed a new computational method for linking molecular marks on our DNA to gene activity. Their work may help researchers connect genes ...

Schematic image of X-ray data-enhanced computational method. Image Credit: University of Tokyo The method predicts structures directly from powder X-ray diffraction patterns, which are created when ...