CO2-philicity of crude oil constituents: A computational study by Lionel T. Fogang, Syed M.S. Hussain, Theis I. Solling

“…The effect of unspecific solvation was included with a polarizable continuum model. In all cases, CO2 has the largest affinity towards the aromatic ring. …”
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Theoretical Study of Copper Complexes: Molecular Structure, Properties, and Its Application to Solar Cells by Jesus Baldenebro-Lopez, Norma Flores-Holguin, Jose Castorena-Gonzalez, Jorge Almaral-Sanchez, Daniel Glossman-Mitnik

“…Solvent effects have been taken into account by an implicit approach, namely, the polarizable continuum model (PCM), using the nonequilibrium version of the IEF-PCM model.…”
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From canonical to unique: extension of a lipophilicity scale of amino acids to non-standard residues by Antonio Viayna, Paulina Matamoros, David Blázquez-Ruano, William J. Zamora

“…In this study, we employ the integral equation formalism polarizable continuum model/Miertus-Scrocco-Tomasi (IEFPCM/MST) implicit solvation model to compute the n-octanol/water partition coefficient, serving as a lipophilic descriptor for non-standard amino acids. …”
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