Computational chemistry, or cheminformatics, combines computer simulations, chemistry theory, and information science to analyze complex chemical problems and predict molecular behaviors.

A new teaching tool adds an innovative twist to the traditional chemistry model kit. Happy Atoms combines augmented reality with a physical product to educate students about the wonderful world of ...

The Data Science and Modeling for Green Chemistry award aims to recognize the research and development of computational tools that guide the design of sustainable chemical processes and the execution ...

Researchers at Google subsidiary DeepMind have open-sourced DM21, a neural network model for mapping electron density to chemical interaction energy, a key component of quantum mechanical simulation.

The purpose of this study is to examine the effects of 'environmental chemistry' elective course via Technology-Embedded Scientific Inquiry (TESI) model on senior science student teachers' (SSSTs) ...

V. Eyring, N. R. P. Harris, M. Rex, T. G. Shepherd, D. W. Fahey, G. T. Amanatidis, J. Austin, M. P. Chipperfield, M. Dameris, P. M. De F. Forster, A. Gettelman, H. F ...

The Columbus, Ohio-headquartered research and development organization will help the military service know the reaction rates for chemical reactions, computer modeling, atmospheric chemistry ...