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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| Description | scientific article published on 21 February 2013 |
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author: Philippe H Hünenberger Niels Hansen Wilfred F van Gunsteren |
| Publication date | February 21, 2013 |
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