Kenneth Merz, Ph.D., of Cleveland Clinic's Center for Computational Life Sciences and a team are exploring how quantum ...

The convergence of photonic quantum computing and neutral atom arrays charts a bold and expansive trajectory for the future ...

Computational Chemistry is the study of complex chemical problems using a combination of computer simulations, chemistry theory and information science. Also called cheminformatics, this field enables ...

Quantum computers hold incredible promise, but one major challenge still stands in the way: their struggle to correct errors ...

His team is now relying on a different computational chemistry technique, also derived from quantum mechanics, known as coupled-cluster theory, or CCSD(T). "This is the gold standard of quantum ...

Exascale computers like Frontier also signal a new era for chemistry, says Theresa Windus, a computational chemist at Iowa State University and Ames National Laboratory.

“That’s why many different companies that essentially have chemistry as their requirement are still investigating quantum—because they know exactly where these approximation methods break ...

Researchers recently published findings that could lay the groundwork for applying quantum computing methods to protein structure prediction. Researchers from Cleveland Clinic and IBM recently ...