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Issue DateTitleAuthor(s)Citation
2006Metal-mediated formation of gas-phase amino acid radical cationsMoran, Damian; Radom, Leo; Barlow, Christopher K.; McFadyen, W. David; O'Hair, Richard A J; Chemistry; ChemistryMetal-mediated formation of gas-phase amino acid radical cations, The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, vol.110,(27),2006,pp 8304-8315
2006Thermochemistry and Kinetics of Hydrogen Abstraction by Methyl Radical from Polycyclic Aromatic HydrocarbonsHemelsoet, Karen; Moran, Damian; Radom, Leo; Marin, Guy B; Van Speybroeck, Veronique; Waroquier, Michel; Chemistry; Chemistry; ChemistryThermochemistry and Kinetics of Hydrogen Abstraction by Methyl Radical from Polycyclic Aromatic Hydrocarbons, The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, vol.110,(50),2006,pp 13624-13631
2006Transfer hydrogenation between ethane and ethene: a critical assessment of theoretical proceduresChan, Bun; Miller, Daniel; Radom, Leo; Smith, David M; Chemistry; Chemistry; ChemistryTransfer hydrogenation between ethane and ethene: a critical assessment of theoretical procedures, Molecular Physics: an international journal in the field of chemical physics, vol.104,(5 to 7),2006,pp 777-794
2006On the electronic properties of dehydrogenated polycyclic aromatic hydrocarbonsKokkin, Damian; Schmidt, Timothy; Chemistry; ChemistryOn the electronic properties of dehydrogenated polycyclic aromatic hydrocarbons, The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, vol.110,(18),2006,pp 6173-6177
2008The Carbon-Skeleton Rearrangement in Tropane Alkaloid BiosynthesisRadom, Leo; Sandala, Gregory; Smith, David M; Chemistry; ChemistryThe Carbon-Skeleton Rearrangement in Tropane Alkaloid Biosynthesis, Journal of the American Chemical Society, vol.130, 32, 2008,pp 10684-10690
2008Lithium monoxide anion: A ground-state triplet with the strongest base to dateChan, Bun; Radom, Leo; Sullivan, Michael; Kass, Steven R; Tian, Zhixin; Chemistry; Chemistry; ChemistryLithium monoxide anion: A ground-state triplet with the strongest base to date, Proceedings of the National Academy of Sciences (PNAS) of the United States of America, vol.105, 22, 2008,pp 7647-7651
2006Predicting the long-time dynamic heterogeneity in a supercooled liquid on the basis of short-time heterogeneitiesHarrowell, Peter; Widmer-Cooper, Asaph; Chemistry; ChemistryPredicting the long-time dynamic heterogeneity in a supercooled liquid on the basis of short-time heterogeneities, Physical Review Letters, vol.96,(18),2006,pp 185701-1-185701-4
2006Non-periodic boundary conditions for molecular simulations of condensed matterAttard, Phillip; ChemistryNon-periodic boundary conditions for molecular simulations of condensed matter, Molecular Physics: an international journal in the field of chemical physics, vol.104,(12),2006,pp 1951-1960
2007Toward an improved understanding of the glutamate mutase systemRadom, Leo; Sandala, Gregory; Marsh, E Neil G; Smith, David M; Chemistry; ChemistryToward an improved understanding of the glutamate mutase system, Journal of the American Chemical Society, vol.129,(6),2007,pp 1623-1633
2007Hydrogenation of simple aromatic molecules: A computational study of the mechanismChan, Bun; Radom, Leo; Zhong, George; Chemistry; Chemistry; ChemistryHydrogenation of simple aromatic molecules: A computational study of the mechanism, Journal of the American Chemical Society, vol.129,(4),2007,pp 924-933