Simulating how atoms and molecules move over time is a central challenge in computational chemistry and materials science.
Molecular dynamics simulations offer a detailed atomic-scale perspective of liquid interfaces, enabling researchers to probe structural and dynamical properties that govern the boundary between ...
Wafer Scale Engine Unlocks 1.1 Million Simulations Steps/Sec, Enabling Scientists to Perform Two Years’ Worth of GPU-Based Simulations in a Single Day on Cerebras SUNNYVALE, Calif.--(BUSINESS ...
Researchers from BIFOLD and Google DeepMind have developed MD-ET, a transformer-based molecular dynamics model that omits traditional physics constraints like energy conservation and equivariance.
Researchers test state-of-the-art models on diverse RNA structures, opening doors for RNA-based therapies and drug design Ribonucleic acid (RNA) is one of life’s most versatile molecules, with roles ...
Cerebras Systems, the maker of an AI “chip” the size of a pizza box, is making some impressive claims about its AI processing performance. At the recent Supercomputing 24 show, Cerebras announced a ...
Researchers have made a meaningful advance in the simulation of molecular electron transfer -- a fundamental process underpinning countless physical, chemical and biological processes. The study ...
KAWASAKI, Japan, Dec 1, 2025 - (JCN Newswire) - - Fujitsu today announced the successful development of a technology for molecular dynamics (MD) simulation that enables atomic-level structural ...
Molten carbon can form into either diamond or graphite. A new study shows how graphite can sometimes form even under conditions that should lead to diamond. (Getty Images) The graphite found in your ...
A major scientific advance in protein modeling developed by Microsoft Research AI for Science, has been published in Science. The study introduces BioEmu, a generative deep learning system that ...
Have you ever wondered how mussels instantly glue themselves to rocks, allowing them to survive the crushing force of ocean ...