Affinity Calculations of Cyclodextrin Host-Guest Complexes: Assessment of Strengths and Weaknesses of End-Point Free Energy Methods

  1. Suárez, D.
  2. Díaz, N.
Journal:
Journal of Chemical Information and Modeling

ISSN: 1520-5142 1549-9596

Year of publication: 2019

Volume: 59

Issue: 1

Pages: 421-440

Type: Article

DOI: 10.1021/ACS.JCIM.8B00805 GOOGLE SCHOLAR