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Acta Chimica Slovaca
Volume 9 (2016): Issue 2 (October 2016)
Open Access
The validation of quantum chemical lipophilicity prediction of alcohols
Martin Michalík
Martin Michalík
and
Vladimír Lukeš
Vladimír Lukeš
| Dec 08, 2016
Acta Chimica Slovaca
Volume 9 (2016): Issue 2 (October 2016)
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Published Online:
Dec 08, 2016
Page range:
89 - 94
DOI:
https://doi.org/10.1515/acs-2016-0015
Keywords
Lipophilicity prediction
,
Validation
,
DFT functionals
,
Alcohols
© 2016 Faculty of Chemical and Food Technology, Slovak University of Technology in Bratislava
This work is licensed under the Creative Commons Attribution-NonCommercial-NoDerivatives 3.0 License.
Martin Michalík
Department of Chemical Physics, Slovak University of Technology in Bratislava, Radlinského 9, SK-812 37 Bratislava, Slovakia
Vladimír Lukeš
Department of Chemical Physics, Slovak University of Technology in Bratislava, Radlinského 9, SK-812 37 Bratislava, Slovakia