Evaluating the Performance of Water Models with Host-Guest Force Fields in Binding Enthalpy Calculations for Cucurbit[7]uril-Guest Systems (2021)
Attributed to:
The UK High-End Computing Consortium for Biomolecular Simulation
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1021/acs.jpcb.0c11383
PubMed Identifier: 33538161
Publication URI: http://europepmc.org/abstract/MED/33538161
Type: Journal Article/Review
Parent Publication: The Journal of Physical Chemistry B
Issue: 6
ISSN: 1520-5207