Search Results - "Fuller, Jack T."

Computational Transition-State Design Provides Experimentally Verified Cr(P,N) Catalysts for Control of Ethylene Trimerization and Tetramerization by Kwon, Doo-Hyun, Fuller, Jack T, Kilgore, Uriah J, Sydora, Orson L, Bischof, Steven M, Ess, Daniel H

“…Computational design of molecular homogeneous organometallic catalysts followed by experimental realization remains a significant challenge. Here, we report…”
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Direct observation of β-alkynyl eliminations from unstrained propargylic alkoxide Cu(i) complexes by C-C bond cleavage by Tran, Ba L, Fuller, 3rd, Jack T, Erickson, Jeremy D, Ginovska, Bojana, Raugei, Simone

“…β-Carbon eliminations of aryl, allylic, and propargylic alkoxides of Rh(i), Pd(ii), and Cu(i) are key elementary reactions in the proposed mechanisms of…”
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Coenzyme Q10 trapping in mitochondrial complex I underlies Leber’s hereditary optic neuropathy by Fuller, Jack T., Barnes, Steven, Sadun, Lorenzo A., Ajmera, Pujan, Alexandrova, Anastassia N., Sadun, Alfredo A.

“…How does a single amino acid mutation occurring in the blinding disease, Leber’s hereditary optic neuropathy (LHON), impair electron shuttling in mitochondria?…”
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Understanding the role of negative charge in the scaffold of an artificial enzyme for CO2 hydrogenation on catalysis by Trevino, Regina E., Fuller, Jack T., Reid, Deseree J., Laureanti, Joseph A., Ginovska, Bojana, Linehan, John C., Shaw, Wendy J.

“…We have approached the construction of an artificial enzyme by employing a robust protein scaffold, lactococcal multidrug resistance regulator, LmrR, providing…”
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Toxic and Physiological Metal Uptake and Release by Human Serum Transferrin by Reilley, David J., Fuller, Jack T., Nechay, Michael R., Victor, Marie, Li, Wei, Ruberry, Josiah D., Mujika, Jon I., Lopez, Xabier, Alexandrova, Anastassia N.

“…An atomistic understanding of metal transport in the human body is critical to anticipate the side effects of metal-based therapeutics and holds promise for…”
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Dehydrogenative B−H/C(sp3)−H Benzylic Borylation within the Coordination Sphere of Platinum(II) by Kelly, Colin M., Fuller, Jack T., Macaulay, Casper M., McDonald, Robert, Ferguson, Michael J., Bischof, Steven M., Sydora, Orson L., Ess, Daniel H., Stradiotto, Mark, Turculet, Laura

“…The first examples of stoichiometric dehydrogenative B−H/C(sp3)−H benzylic borylation reactions, which are of relevance to catalytic methylarene…”
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Global Activity Search Uncovers Reaction Induced Concomitant Catalyst Restructuring for Alkane Dissociation on Model Pt Catalysts by Sun, Geng, Fuller, Jack T, Alexandrova, Anastassia N, Sautet, Philippe

“…Although there is evidence that catalytic active sites can restructure under reaction conditions, their optimal reconstruction to provide the lowest activation…”
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Electrocatalytic Methane Functionalization with d0 Early Transition Metals Under Ambient Conditions by Deng, Jiao, Lin, Sheng‐Chih, Fuller, Jack T., Zandkarimi, Borna, Chen, Hao Ming, Alexandrova, Anastassia N., Liu, Chong

“…The undesirable loss of methane (CH4) at remote locations welcomes approaches that ambiently functionalize CH4 on‐site without intense infrastructure…”
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Alkene Isomerization–Hydroboration Catalyzed by First-Row Transition-Metal (Mn, Fe, Co, and Ni) N‑Phosphinoamidinate Complexes: Origin of Reactivity and Selectivity by Macaulay, Casper M, Gustafson, Samantha J, Fuller, Jack T, Kwon, Doo-Hyun, Ogawa, Takahiko, Ferguson, Michael J, McDonald, Robert, Lumsden, Michael D, Bischof, Steven M, Sydora, Orson L, Ess, Daniel H, Stradiotto, Mark, Turculet, Laura

“…We describe the results of our combined experimental and computational investigation of structurally analogous (N-phosphinoamidinate)­metal­(N­(SiMe3)2)…”
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Tuning through-space interactions via the secondary coordination sphere of an artificial metalloenzyme leads to enhanced Rh( iii )-catalysis by Hassan, Isra S., Fuller, Jack T., Dippon, Vanessa N., Ta, Angeline N., Danneman, Michael W., McNaughton, Brian R., Alexandrova, Anastassia N., Rovis, Tomislav

“…We report computationally-guided protein engineering of monomeric streptavidin Rh( iii ) artificial metalloenzyme to enhance catalysis of the enantioselective…”
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Contrasting Mechanisms and Reactivity of Tl(III), Hg(II), and Co(III) for Alkane C–H Functionalization by Gustafson, Samantha J, Fuller, Jack T, Devarajan, Deepa, Snyder, Justin, Periana, Roy A, Hashiguchi, Brian G, Konnick, Michael M, Ess, Daniel H

“…Activation and functionalization of alkane C–H bonds has historically been dominated by transition-metal complexes. Light alkanes can also be partially…”
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Catalytic Mechanism and Efficiency of Methane Oxidation by Hg(II) in Sulfuric Acid and Comparison to Radical Initiated Conditions by Fuller, Jack T, Butler, Steven, Devarajan, Deepa, Jacobs, Austin, Hashiguchi, Brian G, Konnick, Michael M, Goddard, William A, Gonzales, Jason, Periana, Roy A, Ess, Daniel H

“…Methane conversion to methyl bisulfate by HgII(SO4) in sulfuric acid is an example of fast and selective alkane oxidation catalysis. Dichotomous mechanisms…”
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Electrocatalytic Methane Functionalization with d0 Early Transition Metals Under Ambient Conditions by Deng, Jiao, Lin, Sheng‐Chih, Fuller, Jack T., Zandkarimi, Borna, Chen, Hao Ming, Alexandrova, Anastassia N., Liu, Chong

“…The undesirable loss of methane (CH4) at remote locations welcomes approaches that ambiently functionalize CH4 on‐site without intense infrastructure…”
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Dehydrogenative B−H/C(sp3)−H Benzylic Borylation within the Coordination Sphere of Platinum(II) by Kelly, Colin M., Fuller, Jack T., Macaulay, Casper M., McDonald, Robert, Ferguson, Michael J., Bischof, Steven M., Sydora, Orson L., Ess, Daniel H., Stradiotto, Mark, Turculet, Laura

“…The first examples of stoichiometric dehydrogenative B−H/C(sp3)−H benzylic borylation reactions, which are of relevance to catalytic methylarene…”
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Electrocatalytic Methane Functionalization with d 0 Early Transition Metals Under Ambient Conditions by Deng, Jiao, Lin, Sheng‐Chih, Fuller, Jack T., Zandkarimi, Borna, Chen, Hao Ming, Alexandrova, Anastassia N., Liu, Chong

“…Abstract The undesirable loss of methane (CH 4 ) at remote locations welcomes approaches that ambiently functionalize CH 4 on‐site without intense…”
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A New Stepwise Mechanism for Formation of a Metallacyclobutane via a Singlet Diradical Intermediate by Fuller, Jack T., Harrison, Daniel J., Leclerc, Matthew C., Baker, R. Tom, Ess, Daniel H., Hughes, Russell P.

“…Density functional calculations (M06/def2-TZVP//M06/LACVP** in THF solvent) reveal that the formation of a perfluorometallacyclobutane from…”
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Electrocatalytic Methane Functionalization with d 0 Early Transition Metals Under Ambient Conditions by Deng, Jiao, Lin, Sheng‐Chih, Fuller, Jack T., Zandkarimi, Borna, Chen, Hao Ming, Alexandrova, Anastassia N., Liu, Chong

“…Abstract The undesirable loss of methane (CH 4 ) at remote locations welcomes approaches that ambiently functionalize CH 4 on‐site without intense…”
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Contrasting Mechanisms and Reactivity of Tl(III), Hg(II), and Co(III) for Alkane C–H Functionalization by Gustafson, Samantha J., Fuller, Jack T., Devarajan, Deepa, Snyder, Justin, Periana, Roy A., Hashiguchi, Brian G., Konnick, Michael M., Ess, Daniel H.

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Contrasting Mechanisms and Reactivity of Tl(III), Hg(II), and Co(III) for Alkane C–H Functionalization by Gustafson, Samantha J., Fuller, Jack T., Devarajan, Deepa, Snyder, Justin, Periana, Roy A., Hashiguchi, Brian G., Konnick, Michael M., Ess, Daniel H.

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Global Activity Search Uncovers Reaction Induced Concomitant Catalyst Restructuring for Alkane Dissociation on Model Pt Catalysts by Sun, Geng, Fuller, III, Jack T., Alexandrova, Anastassia N., Sautet, Philippe

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