Capturing Choline-Aromatics Cation-πInteractions in the MARTINI Force Field

  1. Khan, H.M.
  2. Souza, P.C.T.
  3. Thallmair, S.
  4. Barnoud, J.
  5. De Vries, A.H.
  6. Marrink, S.J.
  7. Reuter, N.
Journal:
Journal of Chemical Theory and Computation

ISSN: 1549-9626,  1549-9618

Year of publication: 2020

Volume: 16

Issue: 4

Pages: 2550-2560

Type: Article

DOI: 10.1021/ACS.JCTC.9B01194 GOOGLE SCHOLAR lock_openOpen access editor
Data source: Scopus