Efficient Combination of Environment Change and Alchemical Perturbation within the Enveloping Distribution Sampling (EDS) Scheme

Twin-System EDS and Application to the Determination of Octanol-Water Partition Coefficients
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Author
Hansen, Niels
Hünenberger, Philippe H.
Gunsteren, Wilfred F. van
Date
2013-03
Type
  • Journal Article
Publication status
published
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Journal / series
Journal of Chemical Theory and Computation
Volume
9(3)
Pages
1334 - 1346
Publisher
American Chemical Society
Organisational unit
03304 - Van Gunsteren, Wilfred F. (emeritus)
Notes
Received 27 October 2012.
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Citations
Cited 7 times in Web of Science
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