| Combination of a dinuclear Zn2+ complex and a medium effect exerts a 1012-fold rate enhancement of cleavage of an RNA and DNA model system AA Neverov, ZL Lu, CI Maxwell, MF Mohamed, CJ White, JSW Tsang, ... Journal of the American Chemical Society 128 (50), 16398-16405, 2006 | 77 | 2006 |
| Catalytic stimulation by restrained active-site floppiness—the case of high density lipoprotein-bound serum paraoxonase-1 M Ben-David, JL Sussman, CI Maxwell, K Szeler, SCL Kamerlin, ... Journal of molecular biology 427 (6), 1359-1374, 2015 | 45 | 2015 |
| DFT Computational Study of the Methanolytic Cleavage of DNA and RNA Phosphodiester Models Promoted by the Dinuclear Zn(II) Complex of 1,3-Bis(1,5,9 … CI Maxwell, NJ Mosey, R Stan Brown Journal of the American Chemical Society 135 (45), 17209-17222, 2013 | 38 | 2013 |
| Demonstration of prominent Cu (II)-promoted leaving group stabilization of the cleavage of a homologous set of phosphate mono-, di-, and triesters in methanol CT Liu, AA Neverov, CI Maxwell, RS Brown Journal of the American Chemical Society 132 (10), 3561-3573, 2010 | 34 | 2010 |
| Trifunctional Metal Ion-Catalyzed Solvolysis: Cu(II)-Promoted Methanolysis of N,N-bis(2-picolyl) Benzamides Involves Unusual Lewis Acid Activation of Substrate … MAR Raycroft, CI Maxwell, RAA Oldham, AS Andrea, AA Neverov, ... Inorganic Chemistry 51 (19), 10325-10333, 2012 | 30 | 2012 |
| Mechanistic and computational study of a palladacycle-catalyzed decomposition of a series of neutral phosphorothioate triesters in methanol CT Liu, CI Maxwell, DR Edwards, AA Neverov, NJ Mosey, RS Brown Journal of the American Chemical Society 132 (46), 16599-16609, 2010 | 30 | 2010 |
| Cu (II)-Promoted Methanolysis of N, N-Dipicolylacetamide. Multistep Activation by Decoupling of> N̈–C O Resonance via Cu (II)–N Binding, Delivery of the Cu (II):(− OCH3 … IF Barrera, CI Maxwell, AA Neverov, RS Brown The Journal of Organic Chemistry 77 (8), 4156-4160, 2012 | 28 | 2012 |
| Atomistic simulation study of clustering and evolution of irradiation-induced defects in zirconium C Maxwell, J Pencer, E Torres Journal of Nuclear Materials 531, 151979, 2020 | 27 | 2020 |
| Solvent deuterium kinetic isotope effects for the methanolyses of neutral C= O, P= O and P= S esters catalyzed by a triazacyclododecane: Zn (2+)-methoxide complex. C Maxwell, AA Neverov, RS Brown Organic & biomolecular chemistry 3 (24), 4329, 2005 | 23 | 2005 |
| Molecular dynamics study of hydrogen-vacancy interactions in α-zirconium CI Maxwell, E Torres, J Pencer Journal of Nuclear Materials 511, 341-352, 2018 | 22 | 2018 |
| Kinetic resolution of esters via metal catalyzed methanolysis reactions CI Maxwell, K Shah, PV Samuleev, AA Neverov, RS Brown Organic & Biomolecular Chemistry 6 (15), 2796-2803, 2008 | 12 | 2008 |
| Development of a polarizable interatomic potential for molten lithium, sodium, and potassium nitrate CI Maxwell, M Saoudi, J Pencer The Journal of Physical Chemistry B 124 (23), 4751-4761, 2020 | 11 | 2020 |
| Molecular dynamics modelling of the thermal conductivity of off-stoichiometric UO2±x and (UyPu1− y) O2±x using equilibrium molecular dynamics CI Maxwell, J Pencer Annals of Nuclear Energy 131, 317-324, 2019 | 11 | 2019 |
| Methanolysis of Thioamide Promoted by a Simple Palladacycle Is Accelerated by 108 over the Methoxide-Catalyzed Reaction CT Liu, CI Maxwell, SG Pipe, AA Neverov, NJ Mosey, RS Brown Journal of the American Chemical Society 133 (50), 20068-20071, 2011 | 10 | 2011 |
| Density functional theory study of methoxide promoted and Zn(II)‐complexed methoxide promoted cleavages of aryl‐ and alkyl acetates in methanol. Transition … CI Maxwell, AA Neverov, NJ Mosey, R Stan Brown Journal of Physical Organic Chemistry 27 (5), 419-429, 2014 | 9 | 2014 |
| Transition from concerted to stepwise processes as a function of leaving group ability: density functional theory and experimental study of lyoxide‐promoted cleavages of … CI Maxwell, CT Liu, AA Neverov, NJ Mosey, RS Brown Journal of Physical Organic Chemistry 25 (5), 437-449, 2012 | 8 | 2012 |
| A mechanistic study of the [La2(OCH3)2]4+- and [(1,5,9-triazacyclodo-decane):Zn:(OCH3)]+-catalyzed methanolysis of carbonates: possible application for the … AA Neverov, LD Chen, S George, D Simon, CI Maxwell, RS Brown Canadian Journal of Chemistry 91 (11), 1139-1146, 2013 | 5 | 2013 |
| Experimental and computational determination of Brønsted coefficients for equilibrium transfer of the O,O‐dimethyl phosphorothioyl group between oxyanion … DR Edwards, CI Maxwell, RW Harkness, AA Neverov, NJ Mosey, ... Journal of Physical Organic Chemistry 25 (3), 258-266, 2012 | 5 | 2012 |
| Molecular dynamics study of fission gas behaviour and solubility in molten FLiNaK salt CI Maxwell Journal of Nuclear Materials 563, 153633, 2022 | 4 | 2022 |
| Stochastic core–shell (SCS) approximation for accelerated atomistic modeling of irradiation-induced damage in materials E Torres, C Maxwell, TP Kaloni Computational Materials Science 209, 111337, 2022 | 2 | 2022 |
