Matthew Liptak
Title
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Cited by
Year
Accurate p K a calculations for carboxylic acids using complete basis set and Gaussian-n models combined with CPCM continuum solvation methods
MD Liptak, GC Shields
Journal of the American Chemical Society 123 (30), 7314-7319, 2001
6262001
Absolute p K a determinations for substituted phenols
MD Liptak, KC Gross, PG Seybold, S Feldgus, GC Shields
Journal of the American Chemical Society 124 (22), 6421-6427, 2002
5972002
Suppression of Kasha's rule as a mechanism for fluorescent molecular rotors and aggregation-induced emission
H Qian, ME Cousins, EH Horak, A Wakefield, MD Liptak, I Aprahamian
Nature chemistry 9 (1), 83-87, 2017
2192017
Experimentation with different thermodynamic cycles used for pKa calculations on carboxylic acids using complete basis set and Gaussian‐n models combined …
MD Liptak, GC Shields
International Journal of Quantum Chemistry 85 (6), 727-741, 2001
2112001
Accurate relative calculations for carboxylic acids using complete basis set and Gaussian-n models combined with continuum solvation methods
AM Toth, MD Liptak, DL Phillips, GC Shields
The Journal of Chemical Physics 114 (10), 4595-4606, 2001
1922001
Comparison of CBS-QB3, CBS-APNO, and G3 predictions of gas phase deprotonation data
EK Pokon, MD Liptak, S Feldgus, GC Shields
The Journal of Physical Chemistry A 105 (45), 10483-10487, 2001
1262001
Spectroscopic and computational studies of Co1+ cobalamin: spectral and electronic properties of the “superreduced” B12 cofactor
MD Liptak, TC Brunold
Journal of the American Chemical Society 128 (28), 9144-9156, 2006
1022006
NMR and DFT Investigation of Heme Ruffling: Functional Implications for Cytochrome c
MD Liptak, X Wen, KL Bren
Journal of the American Chemical Society 132 (28), 9753-9763, 2010
912010
The Mycobacterium tuberculosis secreted protein Rv0203 transfers heme to membrane proteins MmpL3 and MmpL11
CP Owens, N Chim, AB Graves, CA Harmston, A Iniguez, H Contreras, ...
Journal of Biological Chemistry 288 (30), 21714-21728, 2013
822013
Comparison of CBS-QB3, CBS-APNO, G2, and G3 thermochemical predictions with experiment for formation of ionic clusters of hydronium and hydroxide ions complexed with water
FC Pickard IV, EK Pokon, MD Liptak, GC Shields
The Journal of chemical physics 122 (2), 024302, 2005
712005
The Proapoptotic G41S Mutation to Human Cytochrome c Alters the Heme Electronic Structure and Increases the Electron Self-Exchange Rate
MD Liptak, RD Fagerlund, EC Ledgerwood, SM Wilbanks, KL Bren
Journal of the American Chemical Society 133 (5), 1153-1155, 2011
542011
Reducing protein oxidation reverses lung fibrosis
V Anathy, KG Lahue, DG Chapman, SB Chia, DT Casey, R Aboushousha, ...
Nature medicine 24 (8), 1128-1135, 2018
522018
Comparison of density functional theory predictions of gas‐phase deprotonation data
MD Liptak, GC Shields
International journal of quantum chemistry 105 (6), 580-587, 2005
492005
Conformational change and human cytochrome c function: mutation of residue 41 modulates caspase activation and destabilizes Met-80 coordination
TM Josephs, MD Liptak, G Hughes, A Lo, RM Smith, SM Wilbanks, ...
JBIC Journal of Biological Inorganic Chemistry 18 (3), 289-297, 2013
402013
Crystallographic and Spectroscopic Insights into Heme Degradation by Mycobacterium tuberculosis MhuD
AB Graves, RP Morse, A Chao, A Iniguez, CW Goulding, MD Liptak
Inorganic chemistry 53 (12), 5931-5940, 2014
372014
Spectroscopic and Computational Characterization of the Base-off Forms of Cob (II) alamin
MD Liptak, AS Fleischhacker, RG Matthews, J Telser, TC Brunold
The Journal of Physical Chemistry B 113 (15), 5245-5254, 2009
342009
CCSD (T), W1, and other model chemistry predictions for gas‐phase deprotonation reactions
FC Pickard IV, DR Griffith, SJ Ferrara, MD Liptak, KN Kirschner, ...
International journal of quantum chemistry 106 (15), 3122-3128, 2006
332006
Spectroscopically validated density functional theory studies of the B12 cofactors and their interactions with enzyme active sites
TC Brunold, KS Conrad, MD Liptak, K Park
Coordination Chemistry Reviews 253 (5-6), 779-794, 2009
312009
Spectroscopically-validated Density Functional Theory Studies of the B12 Cofactors and their Interactions with Enzyme Active Sites
TC Brunold, KS Conrad, MD Liptak, K Park
Coordination Chemistry Reviews 253, 779-794, 2008
312008
Spectroscopic study of the cobalamin-dependent methionine synthase in the activation conformation: Effects of the Y1139 residue and S-adenosylmethionine on the B12 cofactor
MD Liptak, S Datta, RG Matthews, TC Brunold
Journal of the American Chemical Society 130 (48), 16374-16381, 2008
292008
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Articles 1–20