solvation

释义

溶合；溶化；溶剂化作用；溶剂离解作用

Semianalytical treatment of solvation for molecular mechanics and dynamics
Quantum Mechanical Continuum Solvation Models. Chemical Reviews, 105, 2999
Subpicosecond Measurements of Polar Solvation Dynamics: Coumarin 153 Revisited
ChemInform Abstract: Implicit Solvation Models: Equilibria, Structure, Spectra, and Dynamics
The IEF version of the PCM solvation method: an overview of a new method addressed to study molecular solutes at the QM ab initio le...
Universal solvation model based on solute electron density and on a continuum model of the solvent defined by the bulk dielectric co...
Energies, structures, and electronic properties of molecules in solution with the C-PCM solvation model.
Mennucci, B. & Tomasi, J. Continuum solvation models: a new approach to the problem of solutés charge distribution and cavity bound...
A biomolecular force field based on the free enthalpy of hydration and solvation: the GROMOS force-field parameter sets 53A5 and 53A6.
Conductor-like Screening Model for Real Solvents: A New Approach to the Quantitative Calculation of Solvation Phenomena