Reliably assessing the electronic structure of cytochrome P450 on today’s classical computers and tomorrow’s quantum computers
Sign Up to like & getrecommendations! Published in 2022 at "Proceedings of the National Academy of Sciences of the United States of America"
DOI: 10.1073/pnas.2203533119
Abstract: Significance Chemical simulation is one of the most promising applications for future quantum computers. It is thought that quantum computers may enable accurate simulation for complex molecules that are otherwise impossible to simulate classically; that… read more here.
Keywords: quantum computers; assessing electronic; reliably assessing; electronic structure ... See more keywords