Assessment of quantum mechanical continuum models of solvation: the prediction of tautomer equilibria, partition coefficients and amine basicity

P Young, DVS Green, IH Hillier, NA Burton - Molecular Physics, 1993 - Taylor & Francis
Quantum mechanical continuum models of solvation, the self-consistent reaction field
(SCRF), and polarizable continuum method, are used at the ab initio SCF level, to study …
被引用次数：23 相关文章

Assessment of quantum mechanical continuum models of solvation: the prediction of tautomer equilibria, partition coefficients and amine basicity

P Young, DVS Green, IH Hillier, NA Burton - Molecular Physics, 1993 - ingentaconnect.com
Quantum mechanical continuum models of solvation, the self-consistent reaction field
(SCRF), and polarizable continuum method, are used at the ab initio SCF level, to study …

[引用][C] Assessment of quantum mechanical continuum models of solvation: the prediction of tautomer equilibria, partition coefficients and amine basicity

P YOUNG, DVS GREEN, IH HILLIER… - Molecular physics …, 1993 - pascal-francis.inist.fr
Assessment of quantum mechanical continuum models of solvation : the prediction of tautomer
equilibria, partition coefficients and amine basicity CNRS Inist Pascal-Francis CNRS Pascal and …

Assessment of quantum mechanical continuum models of solvation: the prediction of tautomer equilibria, partition coefficients and amine basicity

P Young, DVS Green, IH Hillier… - Molecular Physics, 1993 - ui.adsabs.harvard.edu
Quantum mechanical continuum models of solvation, the self-consistent reaction field
(SCRF), and polarizable continuum method, are used at the ab initio SCF level, to study …

[引用][C] Assessment of quantum mechanical continuum models of solvation: the prediction of tautomer equilibria, partition coefficients and amine basicity

P YOUNG, DVS GREEN, IH HILLIER… - Molecular …, 1993 - Taylor & Francis