A computational method for finding transition states in chemical reactions, greatly reducing computational costs with high reliability, has been devised. Compared to the most widely used existing ...

Computational fluorescence microscopy (CFM) requires accurate point spread function (PSF) characterization for high-quality ...

Proteins are essential for life: while some provide structural integrity to our skin and bones, others regulate the metabolism or recognize and neutralize viruses – to name just a few of their ...

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 ...

If you have a deep-seated, nagging worry over dropping your phone in molten lava, you’re in luck. A research team led by materials scientists at Duke University has developed a method for rapidly ...

Researchers from Turku Bioscience Centre at the University of Turku, Finland, have developed a new computational method to interpret complex single-cell data. The method helps researchers identify and ...

Artificial intelligence (AI) is increasingly transforming computational mechanics, yet many AI-driven models remain limited by poor interpretability, weak generalization, and insufficient physical ...

Ph.D. student Lena Dubinsky and Prof. Leore Grosman from the Computational Archaeology Laboratory at the Hebrew University's Institute of Archaeology have pioneered a new method to study rock ...

Chemists use density functional theory (DFT) to accurately approximate the exact properties—like free energies—of molecules or materials in a reasonable amount of time. The method is widely used even ...

Researchers from Kyushu University have developed an innovative computational method, called ddHodge, that can reconstruct ...