Determination of the N-methyl stereochemistry in tropane and granatane derivatives in solution: a computational and NMR spectroscopic study

Quantum Calculation of Molecular Energies and Energy Gradients in Solution by a Conductor Solvent Model

Vincenzo Barone, Maurizio Cossi · The Journal of Physical Chemistry A · 1998 · 10K citations

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Geometry optimization of molecular structures in solution by the polarizable continuum model

Vincenzo Barone, Maurizio Cossi, Jacopo Tomasi · Journal of Computational Chemistry · 1998 · 1.7K citations

Natural Sciences, Chemistry, Physics +16

p<i>K</i>_a Calculations of Aliphatic Amines, Diamines, and Aminoamides via Density Functional Theory with a Poisson−Boltzmann Continuum Solvent Model

Vyacheslav S. Bryantsev, Mamadou S. Diallo, William A. Goddard · The Journal of Physical Chemistry A · 2007 · 145 citations

Natural Sciences, Chemistry, Medicinal Chemistry +17

No-D NMR (No-Deuterium Proton NMR) Spectroscopy:  A Simple Yet Powerful Method for Analyzing Reaction and Reagent Solutions

Thomas R. Hoye, Brian M. Eklov, Troy D. Ryba et al. · Organic Letters · 2004 · 138 citations

Natural Sciences, Chemistry, Analytical Chemistry +13

Synthesis of Tropane Alkaloids via Enantioselective Deprotonation of Tropinone

Marek Majewski · The Journal of Organic Chemistry · 1995 · 94 citations

Pharmacy, Chemistry, Medicinal Chemistry +7