ULYSSES: An Efficient and Easy to Use Semiempirical Library for C++
Sign Up to like & getrecommendations! Published in 2022 at "Journal of chemical information and modeling"
DOI: 10.1021/acs.jcim.2c00757
Abstract: We introduce ULYSSES, a user-friendly and robust C++ library for semiempirical quantum chemical calculations. In its current version, ULYSSES is equipped with a large set of different semiempirical models, most of which are based on… read more here.
Keywords: easy use; ulysses efficient; use semiempirical; semiempirical library ... See more keywords