About: Aqueous Solvation Free Energies of Ions and Ion−Water Clusters Based on an Accurate Value for the Absolute Aqueous Solvation Free Energy of the Proton

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About: Aqueous Solvation Free Energies of Ions and Ion−Water Clusters Based on an Accurate Value for the Absolute Aqueous Solvation Free Energy of the Proton Goto Sponge NotDistinct Permalink

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article published in 2006

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rdf:type	Item
description	wetenschappelijk artikel (nl) article scientifique publié en 2006 (fr) наукова стаття, опублікована в серпні 2006 (uk) article published in 2006 (en) im August 2006 veröffentlichter wissenschaftlicher Artikel (de)
publication date	wds:Q57250536-8D92C84D-AE29-42E9-8DAD-0D9F19873A2E
publication date	2006-08-01 00:00:00Z (xsd:dateTime)
language of work or name	wds:Q57250536-06248FC4-5340-474E-A00C-40B08A77E3B9
language of work or name	English
author name string	wds:Q57250536-56C406E6-AD7A-40F2-9E33-5288A1D39715
author name string	Casey P. Kelly
rdfs:label	Aqueous Solvation Free Energies of Ions and Ion−Water Clusters Based on an Accurate Value for the Absolute Aqueous Solvation Free Energy of the Proton (en) Aqueous Solvation Free Energies of Ions and Ion−Water Clusters Based on an Accurate Value for the Absolute Aqueous Solvation Free Energy of the Proton (nl)
skos:prefLabel	Aqueous Solvation Free Energies of Ions and Ion−Water Clusters Based on an Accurate Value for the Absolute Aqueous Solvation Free Energy of the Proton (en) Aqueous Solvation Free Energies of Ions and Ion−Water Clusters Based on an Accurate Value for the Absolute Aqueous Solvation Free Energy of the Proton (nl)
name	Aqueous Solvation Free Energies of Ions and Ion−Water Clusters Based on an Accurate Value for the Absolute Aqueous Solvation Free Energy of the Proton (en) Aqueous Solvation Free Energies of Ions and Ion−Water Clusters Based on an Accurate Value for the Absolute Aqueous Solvation Free Energy of the Proton (nl)
author	wds:Q57250536-308E7F10-067B-4095-B67F-B99018EABADB wds:Q57250536-D2F2178F-1645-460A-8781-F4CBA3493085
author	Christopher Cramer Donald Truhlar
title	wds:Q57250536-CCA81773-7BA6-4CE6-AA57-68312C8DFB2F
title	Aqueous Solvation Free Energies of Ions and Ion−Water Clusters Based on an Accurate Value for the Absolute Aqueous Solvation Free Energy of the Proton (en)
page(s)	wds:Q57250536-A99C106B-DCEF-4F3A-B1B6-2F613CEA12D3
page(s)	16066-16081
instance of	wds:Q57250536-7E6E56B2-26B0-41C3-A2BE-AC18EB352E64
instance of	scholarly article
PubMed ID	wds:Q57250536-78124675-B3E5-409D-8ECF-CE6CDAB422C6
PubMed ID	http://rdf.ncbi.nlm.nih.gov/pubchem/reference/16898764
PubMed ID	16898764
published in	wds:Q57250536-36ECD764-B577-4075-8EA7-096F27E11B5C
published in	Journal of Physical Chemistry B
issue	wds:Q57250536-AB9BACF4-C45F-4E8E-9AD5-1512305A7EB1
volume	wds:Q57250536-797D8CCF-F0ED-4998-9530-24A2AEB4F534
issue	32
volume	110
DOI	wds:Q57250536-773F9370-5E02-441A-93F5-1A6032645796
DOI	http://dx.doi.org/10.1021/JP063552Y
DOI	10.1021/JP063552Y
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q57250536
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Self-consistent continuum solvation (SCCS): the case of charged systems. Variational transition state theory: theoretical framework and recent developments. Isodesmic reaction for accurate theoretical pKa calculations of amino acids and peptides Are thermodynamic cycles necessary for continuum solvent calculation of pKas and reduction potentials?

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