Improved solubility and bioactivity of theophylline (a bronchodilator drug) through its new nitrate salt analysed by experimental and theoretical approaches

Large losses of total ozone in Antarctica reveal seasonal ClOx/NOx interaction

J. C. Farman, B. G. Gardiner, J. D. Shanklin · Nature · 1985 · 3.6K citations

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Transferable Scaling Factors for Density Functional Derived Vibrational Force Fields

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On the depletion of Antarctic ozone

Susan Solomon, Rolando R. García, F. S. Rowland et al. · Nature · 1986 · 1.6K citations · Full text

Natural Sciences, Earth Sciences, Environmental Sciences +9

Combination of theoretical ab initio and experimental information to obtain reliable harmonic force constants. Scaled quantum mechanical (QM) force fields for glyoxal, acrolein, butadiene, formaldehyde, and ethylene

Péter Pulay, Géza Fogarasi, Gábor Pongor et al. · Journal of the American Chemical Society · 1983 · 1.6K citations

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The Salt−Cocrystal Continuum:  The Influence of Crystal Structure on Ionization State

S.L. Childs, G. Patrick Stahly, Aeri Park · Molecular Pharmaceutics · 2007 · 1K citations · Full text

Natural Sciences, Biochemistry, Chemistry +17