"A replica exchange umbrella sampling (REUS) approach to predict host-guest ..."

Mahdi Ghorbani et al. (2021)

> Home

Details and statistics

DOI: 10.1007/S10822-021-00385-7

access: open

type: Journal Article

metadata version: 2022-05-13

- view
  - electronic edition via DOI (open access)
  authority control:
- export record
  dblp key:
  - journals/jcamd/GhorbaniHJAMKB21
- ask others
- share record
  persistent URL:
  - https://dblp.org/rec/journals/jcamd/GhorbaniHJAMKB21
Mahdi Ghorbani, Phillip S. Hudson, Michael R. Jones, Félix Aviat, Rubén Meana-Pañeda, Jeffery B. Klauda, Bernard R. Brooks:
A replica exchange umbrella sampling (REUS) approach to predict host-guest binding free energies in SAMPL8 challenge. J. Comput. Aided Mol. Des. 35(5): 667-677 (2021)

manage site settings

To protect your privacy, all features that rely on external API calls from your browser are turned off by default. You need to opt-in for them to become active. All settings here will be stored as cookies with your web browser. For more information see our F.A.Q.