Computational chemistry describes the use of computer modelling and simulation – including ab initio approaches based on quantum chemistry, and empirical approaches – to study the structures ...
Permissively licensed cross-platform tools that provide applications for computational chemistry, materials science, and related areas.
Nobel Prize in Chemistry highlights AI-driven breakthroughs in computational protein design and structure prediction. Tools ...
A new method can improve treatment for patients with chronic myeloid leukemia by predicting which medication will be most ...
A joint research team led by Yuuki Kubo and Shiji Tsuneyuki of the University of Tokyo has developed a new computational ...
This eBook delves into the science behind first-void urine, exploring its composition, collection methods, and the latest ...
The capability and importance of computational methods in organic chemistry is steadily increasing. This Review provides an overview of computational methods for the design of asymmetric catalysts ...
A research team led by Yuuki Kubo and Shiji Tsuneyuki from the University of Tokyo has developed an innovative computational ...
Invent, Amazon Web Services, Inc. (AWS), an Amazon.com, Inc. company (NASDAQ: AMZN), today announced that XtalPi, a leading ...
The Frontier supercomputer's calculations provide a new foundation for simulating the universe's conventional physics, but ...
From October 7 to 10, the winners of the 2024 Nobel Prize were announced in a staggered manner. The awards ceremony will take ...
His work has significant implications for both academic research and industry implementation, particularly in managing large-scale data processing and complex computational tasks. (Please click here ...