Molecular dynamics simulations have become an indispensable tool for understanding the fundamental interactions between atoms and molecules. By utilising carefully derived interatomic potentials, ...
Sandia National Laboratories announced today a new speed record in molecular dynamics simulation. A collaborative research team ran simulations using the Cerebras Wafer Scale Engine (WSE) processor ...
Gordon Bell Prize Awarded To Molecular Dynamics-Quantum Mechanics Mashup On “Frontier” Supercomputer
For years, scientists in the field of molecular dynamics have been squeezed in their research. Traditional simulations that they have been using to track how atoms and molecules move through a system ...
Researchers at the Nano Life Science Institute (WPI-NanoLSI), Kanazawa University, report in the Journal of the American Chemical Societythe ...
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 ...
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