Anharmonic Molecular Mechanics: Ab Initio Based Morse Parametrizations for the Popular MM3 Force Field
- Shannon, R.J.
- Hornung, B.
- Tew, D.P.
- Glowacki, D.R.
ISSN: 1520-5215, 1089-5639
Year of publication: 2019
Volume: 123
Issue: 13
Pages: 2991-2999
Type: Article