Prediction hydration free energies of polychlorinated aromatic compounds from the SAMPL-3 data set with FiSH and LIE models

From National Research Council Canada

DOIResolve DOI: https://doi.org/10.1007/s10822-011-9522-1
AuthorSearch for: 1; Search for: 1
Affiliation
  1. National Research Council of Canada. NRC Biotechnology Research Institute
FormatText, Article
SubjectContinuum solvation; First hydration shell; Linear interaction energy; Prospective study
Abstract
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LanguageEnglish
Peer reviewedYes
NRC numberNRCC 53159
NPARC number20217048
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Record identifiere6e148ab-497d-412a-b4d0-cf03fb806359
Record created2012-06-29
Record modified2020-04-21
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