Source: http://tuttlelab.com/publications/
Timestamp: 2019-04-21 14:06:26+00:00

Document:
Below are the latest publications from the Tuttle Lab.
J. Am. Chem. Soc. 2018 140 9751.
Nocera, G.; Young, A; Palumbo, F.; Emery, K. J.; Coulthard, G.; McGuire, T.; Tuttle, T.; Murphy, J. A.
J. Label Compd. Radiopharm. 2018, 61, 465.
Knox, G.; Kerr, W. J.; Tuttle, T.; Bragg, R.
Emery, K. J.; Young, A.; Arokianathar, J. N.; Tuttle, T.; Murphy, J. A.
Org. Biomol. Chem., 2017, 15, 8810.
Emery, K. J.; Tuttle, T.; Murphy, J. A.
Org. Biomol. Chem. 2017 15 8810.
Kerr, W. J.; Lindsay, D. M.; Owens, P. K.; Reid, M.; Tuttle, T.; Campos, S.
ACS Catal. 2017 7 7182.
Dreanic, M. P.; Edge, C. M.; Tuttle, T.
ACS Omega 2017 2 5737.
Chem. Commun. 2017, 53, 9562.
Abul-Haija, Y. M.; Scott, G. G.; Sahoo, J. K.; Tuttle, T.; Ulijn, R. V.
Chem. Commun. 2017 53 9562.
Sasselli, I. R.; Moreira, I. P.; Ulijn, R. V.; Tuttle, T.
Org. Biomol. Chem. 2017 15 6541.
Angew. Chem. Int. Ed. 2017 56 7808.
Kerr, W. J.; Reid, M.; Tuttle, T.
Lampel, A.; McPhee, S. A.; Park, H-A.; Scott, G. G.; Humagain, S.; Hekstra, D. R.; Barney Yoo, B.; Frederix, P. W. J. M.; Li, T-D.; Abzalimov, R. R.; Greenbaum, S. G.; Tuttle, T.; Hu, C.; Betting, C. J.; Ulijn, R. V.
Moreira, I. P.; Piskorz, T. K.; van Esch, J. H.; Tell Tuttle, T.; Ulijn, R. V.
84. A study of diketopiperazines as electron-donor initiators in transition metal-free haloarene–arene coupling.
Org. Biomol. Chem. 2017 15 3324.
Cumine, F.; Zhou, S.; Tuttle, T.; Murphy, J. A.
ACS Appl. Mater. Interfaces 2017 9 4750.
Chapran, M.; Angioni, E.; Findlay, N. J.; Breig, B.; Vladyslav Cherpak, V.; Stakhira, P.; Tuttle, T.; Volyniuk, D.; Grazulevicius, J. V.; Nastishin, Y. A.; Lavrentovich, O. D.; Skabara, P. J.
Org. Biomol. Chem. 2017 15 920.
Emery, K. J.; Murphy, J. A.; Tuttle, T.
Emery, K. J.; Tuttle, T.; Kennedy, A. R.; Murphy, J. A.
Soft Matter 2016 12 8307.
Sasselli, I. R.; Pappas, C. G.; Matthews, E.; Wang, T.; Hunt, N. T.; Ulijn, R. V.; Tuttle, T.
79. Elucidation of the bonding of a near infrared dye to hollow gold nanospheres – a chalcogen tripod.
Chem. Sci. 2016 7 5160.
Kearns, H.; Sengupta, S.; Ramos Sasselli, I.; Bromley III, L.; Faulds, K.; Tuttle, T.; Bedics, M. A.; Detty, M. R.; Velarde, L.; Graham, D.; Smith, W. E.
78. KOtBu: A Privileged Reagent for Electron Transfer Reactions?
J. Am. Chem. Soc. 2016 138 7402.
Barham, J. P.; Coulthard, G.; Emery, K. J.; Doni, E.; Cumine, F.; Nocera, G.; John, M. P.; Berlouis, L. E. A.; McGuire, T.; Tuttle, T.; Murphy, J. A.
J. Mater. Chem. C 2016 4 3851.
Angioni, E.; Chapran, M.; Ivaniuk, K.; Kostiv, N.; Charpak, V.; Stakhira, P.; Lazauskas, A.; Tamulevičius, S.; Volyniuk, D.; Findlay, N. J.; Tuttle, T.; Grazulevicius, J. D.; Skabara, P. J.
ACS Nano 2016 10 2661.
Soft Matter 2016 12 2623.
Phys. Chem. Chem. Phys. 2016 18 4659.
RSC Advances 2016 6 11335.
J. Phys. Chem. Lett. 2015 6 3944.
Cannon, D. A.; Ashkenasy, N.; Tuttle, T.
Taylor, R. G. D.; Cameron, J.; Wright, I. A.; Thomson, N.; Avramchenko, O.; Kanibolotsky, A. L.; Inigo, A. R.; Tuttle, T.; Skabara, P. J.
Devlin, J.; Kerr, W. J.; Lindsay, D. M.; McCabe, T. J. D.; Reid, M.; Tuttle, T.
Frederix, P. W. J. M.; Scott, G. G.; Abul-Haija, Y. M.; Kalafatovic, D.; Pappas, C. G.; Javid, N.; Hunt, N. T.; Ulijn, R. V.; Tuttle, T.
Shengze Zhou, S.-z.; Doni, E.; Anderson, G. M.; Kane, R. G.; MacDougall, S. W.; Ironmonger, V.; Tuttle, T.; Murphy, J. A.
Orofino-Pena, C.; Cortizo-Lacalle, D.; Cameron, J.; Sajjad, M. T.; Manousiadis, P. P.; Findlay, N. J.; Kanibolotsky, A. L.; Amarasinghe, D.; Skabara, P. J.; Tuttle, T.; Turnbull, G. A.; Samuel, I. D. W.
Cortizo-Lacalle, D.; Howells, C. T.; Pandey, U. K.; Cameron, J.; Findlay, N. J.; Inigo, A. R.; Tuttle, T.; Skabara, P. J.; Samuel, I. D. W.
Maeda, Y.; Javid, N.; Duncan, K.; Birchall, L.; Gibson, K. F.; Cannon, D.; Kanetsuki, Y.; Knapp, C.; Tuttle, T.; Ulijn, R. V.; Matsui, H.
Brown, J. A.; Cochrane, A. R.; Irvine, S.; Kerr, W. J.; Mondal, B.; Parkinson, J. A.; Paterson, L. C.; Reid, M.; Tuttle, T.; Andersson, S.; Nilsson, G. N.
Orr, D.; Percy, J. M.; Tuttle, T.; Kennedy, A. R.; Harrison , Z. A.
Frederix, P. W. J. M.; Adamczyk, K.; Wright, J. A.; Tuttle, T.; Ulijn, R. V.; Pickett, C. J.; Hunt, N. T.
Young, A.; Vincent, M. A.; Hillier, I. H.; Percy, J. M.; Tuttle, T.
Cochrane, A. R.; Idziak, C.; Kerr, W. J.; Mondal, B.; Paterson, L. C.;Tuttle, T.; Andersson, S.;Nilsson, G. N.
O’Sullivan, S.; Doni, E.; Tuttle, T.; Murphy, J. A.
55. Organic Super-Electron-Donors: Initiators in Transition Metal-Free Haloarene-Arene Coupling.
Zhou, S.; Anderson, G. M.; Mondal, B.; Doni, E.; Ironmonger, V.; Kranz, M.; Tuttle, T.; Murphy, J. A.
Mondal, B.; Wilkes, R. D.; Percy, J. M.; Tuttle, T.; Black, R. J. G.; North, C.
Fleming, S.; Debnath, S.; Frederix, P. W. J. M.; Tuttle, T.; Ulijn, R. V.
Doni, E.; Mondal, B.; O’Sullivan, S.; Tuttle, T.; Murphy, J. A.
Fleming, S.; Frederix, P. W. J. M.; Ramos-Sasselli, I.; Hunt, N. T.; Ulijn, R. V.; Tuttle, T.
50. Incorporation of perfluorohexyl-functionalised thiophenes into oligofluorene-truxenes: synthesis and physical properties.
Thomson, N.; Kanibolotsky, A. L.; Cameron, J.; Tuttle, T.; Findlay, N. J.; Skabara, P. J.
Caldwell, N.; Jamieson, C.; Simpson, I.; Tuttle, T.
48. Stabilization of metastable hydrogen trioxide (HOOOH) and the hydrotrioxyl radical (HOOO•) by complexation with sulfuric acid. A theoretical study.
Cannon, D.; Tuttle, T.; Koller, J.; Plesnicar, B.
Kovacevic, L. S.; Idziak, C.; Markevicius, A.; Scullion, C.; Corr, M. J.; Kennedy, A. R.; Tuttle, T.; Murphy, J. A.
Hughes, M.; Frederix, P. W. J. M.; Raeburn, J.; Birchall, L. S.; Sadownik, J.; Coomer, F. C.; Lin, I-H.; Cussen, E. J.; Hunt, N. T.; Tuttle, T.; Webb, S. J.; Adams, D. J.; Ulijn, R. V.
Wright, I. A.; Kanibolotsky, A. L.; Cameron, J.; Tuttle, T.; Skabara, P. J.; Coles, S. J.; Howells, C. T.; Thomson, S. A. J.; Gambino, S.; Samuel, I. D. W.
Jolly, P. I.; Zhou, S.; Thomson, D. W.; Garnier, J.; Parkinson, J. A.; Tuttle, T.; Murphy, J. A.
Dodds, C. A.; Spicer, M. D.; Tuttle, T.
Hughes, M.; Xu, H.; Frederix, P. W. J. M.; Smith, A. M.; Hunt, N. T.; Tuttle, T.; Kinloch, I. A.; Ulijn, R. V.
Frederix, P. W. J. M.; Ulijn, R. V.; Hunt, N. T.; Tuttle, T.
39. Main Group Multiple C-H/N-H Bond Activation of a Diamine and Isolation of a Molecular Dilithium Zincate Hydride: Experimental and DFT Evidence for Alkali Metal-Zinc Synergistic Effects.
Campbell, R.; Cannon, D.; Garcia-Alvarez, P.; Kennedy, A. R.; Mulvey, R. E.; Robertson, S. D.; Sassmannshausen, J.; Tuttle, T.
Birchall, L. S.; Roy, S.; Jayawarna, V.; Hughes, M.; Irvine, E.; Okorogheye, G. T.; Saudi, N.; De Santis, E.; Tuttle, T.; Edwards, A. A.; Ulijn, R. V.
Fleming, S.; Mills, A.; Tuttle, T.
Findlay, N. J.; Park, S. R.; Schoenebeck, F.; Cahard, E.; Zhou, S-z.; Berlouis, L. E. A.; Spicer, M. D.; Tuttle, T.; Murphy, J. A.
Edwards, A. A.; Birchall, L. S.; Jayawarna, V.; Roy, S.; Hughes, M.; Tuttle, T.; Saudi, N.; Okorgheye, G.; Ulijn, R. V.
Tuttle, T.; Cerkovnik, J.; Koller, J.; Plesnicar, B.
33. Applications of QM/MM in Inorganic Chemistry.
32. Effect of Alkali on Methylene Blue (C.I. Basic Blue 9) and other Thiazine Dyes.
Mills, A.; Hazafy, D.; Parkinson, J. A.; Tuttle, T.; Hutchings, M. G.
31. Structural Tracking of the Potassium-Mediated Magnesiation of Anisole.
Clegg, W.; Conway, B.; Garcia-Alvarez, P.; Kennedy, A. R.; Mulvey, R. E.; Russo, L.; Sassmannshausen, J.; Tuttle, T.
29. Averaging Semiempirical NMR Chemical Shifts: Dynamic Effects on the Subpicosecond Time Scale.
Tuttle, T.; Wang, D.; Thiel, W.; Kohler, J.; Hofmann, M.; Weis, J.
Cerkovnik, J.; Plesnicar, B.; Koller, J.; Tuttle, T.
26. The Electronic Structure of Iron Corroles: A Combined Experimental and Quantum Chemical Study.
Ye, S.; Tuttle, T.; Bill, E.; Simkhovich, L.; Gross, Z.; Thiel, W.; Neese, F.
25. An Efficient Methyltrioxorhenium(VII)-Catalyzed Transformation of Hydrotrioxides (ROOOH) into Dihydrogen Trioxide (HOOOH).
Bergant, A.; Cerkovnik, J.; Plesnicar, B.; Tuttle, T.
Kovacic, S.; Koller, J.; Cerkovnik, J.; Tuttle, T.; Plesnicar, B.
22. Design of a New Warhead for the Natural Enediyne Dynemicin A. An Increase of Biological Activity.
Kraka, E.; Tuttle, T.; Cremer, D.
21. The Reductive Cleavage of Sulfones and Sulfonamides By a Neutral Organic Super-Electron Donor (s.e.d) Reagant.
Schöenebeck, F.; Murphy, J. A.; Zhou, S-z.; Uenoyama, Y.; Miclo, Y.; Tuttle, T.
Tuttle, T.; Kraka, E.; Thiel, W.; Cremer, D.
18. Substrate Orientation in 4-oxalocrotonate Tautomerase and its Effect on QM/MM Energy Profiles.
17. The Generation of Aryl Anions By Double Electron Transfer To Aryl Iodides From a Neutral Ground-state Organic Super-electron Donor.
Murphy, J. A.; Zhou, S-z.; Thomson, D. W.; Schöenebeck, F.; Mahesh, M.; Park, S. R.; Tuttle, T.; Berlouis, L. E. A.
16. Mechanism of Olefin Hydrosilylation Catalyzed By [RuCl(NCCH3)5]+: a DFT Study.
Tuttle, T.; Wang, D.; Thiel, W.; Köhler, J.; Hofmann, M.; Weis, J.
15. Latrunculin Analogues with Improved Biological Profiles By “diverted Total Synthesis”: Preparation, Evaluation and Computational Analysis.
Fürstner, A.; Kirk, D.; Fenster, M. D. B.; Aïssa, C.; De Souza, D.; Nevado, C.; Tuttle, T.; Thiel, W.; Müller, O.
14. Understanding the Enzymatic Activity of 4-oxalocrotonate and its Mutant Analogs: a Computational Study.
Tuttle, T.; Keinan, E.; Thiel, W.
13. Mechanism of Olefin Hydrosilylation Catalyzed By RuCl2(CO)2(PPh3)2: a DFT Study.
Cerkovnik, J.; Tuttle, T.; Kraka, E.; Lendero, N.; Plesnicar, B.; Cremer, D.
11. Docking, Triggering, and Biological Activity of Dynemicin a in DNA: a Computational Study.
Tuttle, T.; Kraka, E.; Cremer, D.
10. Elucidation of the Electronic Structure of Molecules with the Help of NMR Spin-spin Coupling Constants: the FH Molecule.
Grafenstein, J.; Tuttle, T.; Cremer, D.
9. Analysis of Long-range NMR Spin-spin Coupling in Polyenes and the π-mechanism.
8. Hemiortho Esters and Hydrotrioxides As the Primary Products in the Low-temperature Ozonation of Cyclic Acetals: An Experimental and Theoretical Investigation.
Tuttle, T.; Cerkovnik, J.; Plesnicar, B.; Cremer, D.
7. Analysis of the NMR Through-space Coupling Mechanism Between F-19 Atoms.
Tuttle, T.; Grafenstein, J.; Cremer, D.
6. Decomposition of Nuclear Magnetic Resonance Spin-spin Coupling Constants Into Active and Passive Orbital Contributions.
5. Investigation of the Nmr Spin-spin Coupling Constants Across the Hydrogen Bonds in Ubiquitin: the Nature of the Hydrogen Bond As Reflected By the Coupling Mechanism.
Tuttle, T.; Kraka, E.; Wu, A.; Cremer, D.
Tuttle, T.; Grafenstein, J.; Wu, A.; Kraka, E.; Cremer, D.
3. Molecular Modelling and Design of Radiolabelled Complexes for Melanoma Diagnosis.
Tuttle, C.T.T.; Seabrook, S.A.; Wise, L.E.; Knott, R.B.; Yates, B.F.
Plesnicar, B.; Tuttle, T.; Cerkovnik, J.; Koller, J.; Cremer, D.
Plesnicar, B.; Cerkovnik, J.; Tuttle, T.; Kraka, E.; Cremer, D.
J. Am. Chem. Soc. 2002 124 11260.

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