Quantitative studies on molecular recognition : free energy perturbation simulations on M+⊂222 cryptates in water and in methanol
J. Chim. Phys., 88 (1991) 2525-2534
Published online: 2017-05-29
Articles citing this article
The Citing articles tool gives a list of articles citing the current article.
The citing articles come from EDP Sciences database, as well as other publishers participating in CrossRef Cited-by Linking Program. You can set up your personal account to receive an email alert each time this article is cited by a new article (see the menu on the right-hand side of the abstract page).
Cited article:
This article has been cited by the following article(s):
Computational Chemistry
Ralph Puchta, Svetlana Begel and Rudi van EldikAdvances in Inorganic Chemistry, Computational Chemistry 73 445 (2019)
https://doi.org/10.1016/bs.adioch.2018.10.005
Host–guest complexes of mixed glycol-phenanthroline cryptands: prediction of ion selectivity by quantum chemical calculations IV
Ralph Puchta and Rudi EldikJournal of Inclusion Phenomena and Macrocyclic Chemistry 60 (3-4) 383 (2008)
https://doi.org/10.1007/s10847-007-9388-y
On the relative stabilities of the alkali cations 222 cryptates in the gas phase and in water-methanol solution
Elisa S. Leite, Sidney R. Santana, Philippe H. Hünenberger, Luiz C. G. Freitas and Ricardo L. LongoJournal of Molecular Modeling 13 (9) 1017 (2007)
https://doi.org/10.1007/s00894-007-0213-8
Alkali ion–cryptand interactions and their effects on electrolyte conductivity
Zenong Ding, D. E. Ellis, E. Sigmund, W. P. Halperin and D. F. ShriverPhys. Chem. Chem. Phys. 5 (10) 2072 (2003)
https://doi.org/10.1039/B212879A
Solubility of Organic Compounds in Water/Octanol Systems. A Expanded Ensemble Molecular Dynamics Simulation Study of logPParameters
Alexander P. Lyubartsev, Sven P. Jacobsson, Göran Sundholm and Aatto LaaksonenThe Journal of Physical Chemistry B 105 (32) 7775 (2001)
https://doi.org/10.1021/jp0036902
16 217 (2000)
https://doi.org/10.1002/9780470125939.ch4
Adsorption of Ionophores and of Their Cation Complexes at the Water/Chloroform Interface: A Molecular Dynamics Study of a [2.2.2]Cryptand and of Phosphoryl‐Containing Podands
A. Varnek, L. Troxler and G. WipffChemistry – A European Journal 3 (4) 552 (1997)
https://doi.org/10.1002/chem.19970030410
Solvent and counterion effects on complexation selectivity by conformationally locked calix[4]-bis-crown ligands: Molecular Dynamics and Free Energy Perturbation studies in water and methanol, acetonitrile and chloroform solutions
A. Varnek and G. WipffJournal of Molecular Structure: THEOCHEM 363 (1) 67 (1996)
https://doi.org/10.1016/0166-1280(95)04425-6
The Macrobicyclic Cryptate Effect in the Gas Phase
Qizhu Chen, Kevin Cannell, Jeremy Nicoll and David V. DeardenJournal of the American Chemical Society 118 (27) 6335 (1996)
https://doi.org/10.1021/ja953460e
Complexation of alkali cations by calix[4]crown ionophores: Conformation and solvent dependent Na+/Cs+binding selectivity and extraction: MD simulations in the gas phase, in water and at the chloroform-water interface
G. Wipff and M. LauterbachSupramolecular Chemistry 6 (1-2) 187 (1995)
https://doi.org/10.1080/10610279508032535
Computational Approaches in Supramolecular Chemistry
G. Wipff and L. TroxlerComputational Approaches in Supramolecular Chemistry 319 (1994)
https://doi.org/10.1007/978-94-011-1058-7_22
Selective complexation of UO 2 2+ by the calix[6]arene6? anion: Structure and hydration studied by molecular dynamics simulations
P. Guilbaud and G. WipffJournal of Inclusion Phenomena and Molecular Recognition in Chemistry 16 (2) 169 (1993)
https://doi.org/10.1007/BF00709150
Molecular Modeling Studies on Molecular Recognition: Crown Ethers, Cryptands and Cryptates. From Static Modelsin vacuoto Dynamical Models in Solution
Georges WipffJournal of Coordination Chemistry 27 (1-3) 7 (1992)
https://doi.org/10.1080/00958979209407942