Chemistry faculty publications, since 2007
*UW-Eau Claire undergraduate student co-authors
†UW-Eau Claire faculty corresponding authors)
2023
- Fossum, C. J.*, Johnson, B. O. V.*, Golde, S. T.*, Kielman, A. J.*, Finke, B.*, Lowater, H. R.*, Laatsch, B.*, Bhattacharyya, S.†, & Hati, S†, "Insight into the Mechanism of Tryptophan Fluorescence Quenching due to Synthetic Crowding Agents: A Combined Experimental and Computational Study" ACS Omega, 2023, 8, 44820-44830. https://doi.org/10.1021/acsomega.3c06006.
- Parsons, S. W.*, Hucek, D. G.*, Mishra, P., Plusquellic, D. F., Zwier, T. S., & Drucker, S†. "Jet-Cooled Phosphorescence Excitation Spectrum of the T1(n,π*) ← S0 Transition of 4H-Pyran-4-one" The Journal of Physical Chemistry A. 2023, 127, 3636-3647. DOI: https://doi.org/10.1021/acs.jpca.3c01059
- Laatsch, B. F.*, Brandt, M.*, Finke, B.*, Fossum, C. J.*, Wackett, M. J.*, Lowater, H. R.*, Narkiewicz-Jodko, A.*, Le, C. N.*, Yang, T., Glogowski, E. M., Bailey-Hartsel, S. C., Bhattacharyya, S.†, & Hati, S†, "Polyethylene Glycol 20k. Does It Fluoresce?" ACS Omega, 2023, 8, 14208–14218. DOI: https://doi.org/10.1021/acsomega.3c01124
- Vermeuel, M. P., Novak, G. A., Kilgour, D. B., Clafin, M. S., Lerner, B. M., Thom, J., Cleary, P. A., Desai, A. R., Bertram, T. H. “Leaf senescence alters Ambient BVOC over a mixed temperate forest” Atmospheric Chemistry and Physics, 2023, 23, 4123–4148. DOI:https://doi.org/10.5194/acp-23-4123-2023
- Tirado, J.*, Torti, A.*, Butterworth, B.*, Wangen, K.*, Voon, A.*, Kies, B.*, Hupy, J., de Boer, G., Pierce, R. B., Wagner, T. J., Cleary, P. A.†, “Observations of Coastal Dynamics During Lake Breeze at a Shoreline Impacted by High Ozone” Environmental Science: Atmospheres 2023 3, 494-505. DOI: https://doi.org/10.1039/D2EA00101B
2022
- Soares, C.*, Ley, A. R.*, Zehner, B. C.*, Treacy, P. W.*, Phillips, J. A.† "Matrix Effects on Hydrogen Bonding and Proton Transfer in Fluoropyridine – HCl Complexes" Physical Chemistry Chemical Physics, 2022, 24, 2371–2386. DOI:https://doi.org/10.1039/D1CP04110J
- Pollock, A. A.*, Huther, H. A.*,Birch, C. M.*, Reinheimer, E. W., Lewis, D. E., Gerlach, D. L†, "Crystal Structure of 2-(2,2,6,6-Tetramethyl-4-piperidinyl)-6-[(2,2,6,6-tetramethyl-4-piperidinyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione" Acta Crystallographica Section E: Crystallographic Communications, 2022, 78, 1161-1164. DOI:https://doi.org/10.1107/S2056989022010374
- Soares, C.*, Ley, A. R.*, Zehner, C.B.*, Treacy, P. W.*, Phillips, J. A.† "Matrix Effects on Hydrogen Bonding and Proton Transfer in Fluoropyridine - HCl Complexes" Physical Chemistry Chemical Physics, 2022, 24, 2371.
- Wysocki, M. M.*, Puzovic, G.*, Dowell, K. L.*, Reinheimer, E. W., Gerlach, D. L.†, “Crystal Structure of 1H-Imidazole-1-methanol", Acta Crystallographica Section E: Crystallographic Communications, 2022, E78, 377-380.
- Wozney, A. J.*, Smith, M. A.*, Abdrabbo, M.*, Birch, C. M.*, Cicigoi, K. A.*, Dolan, C. C.*, Gerzema, A. E. L.*, Hansen, A.*, Henseler, E. J.*, LaBerge, B.*, Leavens, C. M.*, Le, C. N.*, Lindquist, A. C.*, Ludwig, R. K.*, O'Reilly, M. G.*, Reynolds, J. H.*, Sherman, B. A.*, Sillman, H. W.*, Smith, M. A.*, Snortheim, M. J.*, Svaren, L. M.*, Vanderpas, E. C.*, Wackett, M. J.*, Wwiss, M. M.*, Hati, S.† and Bhattacharyya, S.†, "Evolution of Stronger SARS-CoV-2 Variants as Revealed Through the Lens of Molecular Dynamics Simulations" The Protein Journal, 2022, 41, 1-13. DOI: https://doi.org/10.1007/s10930-022-10065-6.
- Fossum, C. J.*, Laatsch, B. F.*, Lowater, H. R.* Narkiewicz-Jodko*, A. R.*, Lonzarich, L.*, Hati S. † and Bhattacharyya, S.† "Pre-existing Oxidative Stress Creates a Docking-Ready Conformation of the SARS-CoV-2 Receptor Binding Domain" ACS Bio & Med Chem Au., 2022, 2, 84–93. (DOI: https://doi.org/10.1021/acsbiomedchemau.1c00040).
- Cleary, P.A., † G de Boer, S. Borenstein, J. Hamilton, J. Hupy, B. Kies*, D. Lawrence, R.B. Pierce, J. Tirado*, A. Voon*, T. Wagner, “Observations of the Lower Atmosphere from the 2021 WiscoDISCO Campaign” Earth System Science Data, 2022, 14, 2129-2145. DOI:https://doi.org/10.5194/essd-14-2129-2022
- Cleary, P.A., † A. Dickens, M. McIlquham *, M. Sanchez *, K. Geib *, C. Hedberg *, J. Hupy, M. W. Watson, M. Fuoco, E.R. Olson, R.B. Pierce, C. Stanier, R Long, L. Valin, S Conley, M. Smith. “Impacts of Lake Breeze meteorology on ozone gradient observations along Lake Michigan Shorelines in Wisconsin: 2017 LMOS examples. Atmospheric Environment, 2022, 269. DOI:https://doi.org/10.1016/j.atmosenv.2021.118834
- Stanier, C. O, Pierce, R. B., Abdi-Oskouei, M., Adelman, Z. E., Al-Saadi, J., Alwe, H. D., Bertram, T. H., Carmichael, G. R., Christiansen, M. B., Cleary, P. A., Czarnetzki, A. C., Dickens, A. F., Fuoco, M. A., Hughes, D. D., Hupy, J. P., et al. "Overview of the Lake Michigan Ozone Study 2017" Bulletin of the American Meteorological Society, 2022, 102, E2207-E2225. PMID 35837596. DOI: https://doi.org/10.1175/BAMS-D-20-0061.1
2021
- Abdrabbo, M.*, Birch, C. M.*, Brandt, M., K. A.*, Coffey, S. J.*, Dolan, C. C.*, Dvorak, H.*, Gehrke, A. C.*, Gerzema, A. E. L.*, Hansen, A.*, Henseler, E. J.*, Huelsbeck, A. C.*, LaBerge, B.*, Leavens, C. M.*, Le, C. N.*, Lindquist, A. C.*, Ludwig, R. K.*, Reynolds, J. H.*, Severson, N. J.*, Sherman, B. A.*, Sillman, H. W.*, Smith, M. A.*, Smith, M. A.*, Snortheim, M. J.*, Svaren, L. M.*, Vanderpas, E. C.*, Wackett, M. J.*, Wozney, A. J.*, Bhattacharyya, S., and Hati, S. “Vitamin D and COVID-19: A Review on the Role of Vitamin D in Preventing and Reducing the Severity of COVID-19 Infection”, Protein Science , 2021 , 30 , 2206-2220. DOI: https://doi.org/10.1002/pro.4190)).
- Munos, J. A.*, Lowney, D. T.*, and Phillips J. A.†, “Structural and energetic properties of OC–BX3 complexes: unrealized potential for bond-stretch isomerism”, Phys. Chem. Chem. Phys., 2021, 23, 14678-14686. DOI: https://doi.org/10.1039/D1CP02230J.
- Butterworth, B. J., Desai, A. R., Metzger, S., Townsend, P. A., Schwartz, M. D., Petty, G. W., Mauder, M., Vogelmann, H., Andresen, C. G., Augustine, T. J., Bertram, T. H., Brown, W. O. J., Buban, M., Cleary, P., Durden, D. J., Florian, C. R., Iglinski, T. J., Kruger, E. L., Lantz, K., Lee, T. R., Meyers, T. P., Mineau, J. K., Olson, E. R., Oncley, S. P., Paleri, S., Pertzborn, R. A., Pettersen, C., Plummer, D. M., Riihimaki, L. D., Guzman, E. R., Sedlar, J., Smith, E. N., Speidel, J., Stoy, P. C., Sühring, M., Thom, J. E., Turner, D. D., Vermeuel, M. P., Wagner, T. J., Wang, Z., Wanner, L., White, L. D., Wilczak, J. M., Wright, D. B., Zheng, T. “Connecting Land-Atmosphere Interactions to Surface Heterogeneity in CHEESEHEAD 2019” Bulletin of the American Meteorological Society, 2021, 102(2), E421- E445. DOI: https://doi.org/10.1175/BAMS-D-19-0346.1.
- Stanier, C. O., Pierce, R. B., Abdi-Oskouei, M., Adelman, Z. E., Al-Saadi, J., Alwe, H. D., Bertram, T. H., Carmichael, G. R., Christiansen, M. B., Cleary, P. A., Czarnetzki, A. C., Dickens, A. F., Fuoco, M. A., Hughes, D. D., Hupy, J. P., Janz, S. J., Judd, L. M., Kenski, D., Kowalewski, M. G., Long, R. W., Millet, D. B., Novak, G., Roozitalab, B., Shaw, S. L., Stone, E. A., Szykman, J., Valin, L., Vermeuel, M., Wagner, T. J., Whitehill, A. R., Williams, D. J. “Overview of the Lake Michigan Ozone Study 2017” Bulletin of the American Meteorological Society. , 2021 (DOI: https://doi.org/10.1175/BAMS-D-20-0061.1).
- Doak, A.G., Christiansen, M. B., Alwe, H. D., Bertram, T. H., Carmichael, G., Cleary, P., Czarnetzki, A.C., Dickens, A.F., Janssen, M., Kenski, D., Millet, D. B., Novak, G., Pierce, R.B., Stone, E.A., Szykman, J., Vermeuel, M., Wagner, T.J., Valin, L., Stanier. C.O. “Characterization of ground-based atmospheric pollution and meteorology sampling stations during the Lake Michigan Ozone Study 2017” Journal of Air and Waste Managers Association, 2021, 71(7), 866-889.DOI: https://doi.org/10.1080/10962247.2021.1900000.
- Lewis, D. E.† "Aleksei Yevgen'evich Chichibabin (1871-1945) and Pyridine Chemistry," Synform 2021/05, A173–A178.(https://www.thieme.de/statics/dokumente/thieme/final/en/dokumente/tw_chemistry/CFZ-Synform-Chichibabin-NRBio.pdf)
- Brock, W. H.; Lewis, D. E.† "A Different Kind of Nierenstein Reaction. The Chemical Society’s Mistreatment of Maximilian Nierenstein," Ann. Sci. 2021, 78, 221–245. DOI: hhttps://doi.org/10.1080/00033790.2021.1917657.
- Lewis, D. E.† "The Logic Behind Markovnikov's Rule. Was It an Inspired Guess? …No!" Angew. Chem. Int. Ed. 2021, 60, 4412–4421. DOI: 10.1002/anie.202008228.
- Vermeuel, M.P., P.A. Cleary, A.R. Desai, T.H. Bertram “Simultaneous measurements of O3 and HCOOH vertical fluxes indicate that rapid in-canopy terpene chemistry drives O3 deposition in mixed temperate forests.” Geophysical Research Letters. 48, 3 (2021) doi.org/10.1029/2020GL090996
2020
- Phillips, J. A., Ley, A. R.*, Treacy, P. W.*, Wahl, B. M.*, Zehner, B. C.*, Donald, K. J., Gillespie, S. “Structural and energetic properties of RMX3-NH3 complexes”, Int. J. Quantum Chem. 2020, 120, e26383. (DOI: https://doi.org/10.1002/qua.26383).
- Coonen, L.*, Gajeski, A.*, Meier, A.*, Reiter, S.*, and Bailey-Hartsel, S. † "Analysis of Beer Volatiles Using Floating Solid-Phase Microextraction: Collaboration of Microbreweries with Local Universities", MBAA Technical Quarterly, 2020, 57(3), 162-166 (DOI: https://doi.org/10.1094/TQ-57-3-0901-01).
- Dressler, J. J.*; Charlesworth-Seiler, E. M.*; Dahl, B. J.† “Synthesis of a Triethylene Glycol-Capped Benzo[1,2-c:4,5-c']bis[2]benzopyran-5,12-dione: A Highly Soluble Dilactone-Bridged p-Terphenyl with a Crankshaft Architecture.” Tetrahedron Lett., 2020, 61, 152429 (DOI: https://doi.org/10.1016/j.tetlet.2020.152429).
- Meyer, S. M.*; Charlesworth-Seiler, E. M.*; Patrol, J. G.*; Kitzrow, J. P.*; Gerlach, D. A.; Reinheimer, E. W.; Dahl, B. J.† “Synthesis and Optical Properties of a Library of Isomeric Aryldibenzopyrylium Halochromic Cations.” Tetrahedron, 2020, 76,131222. (DOI: https://doi.org/10.1016/j.tet.2020.131222).
- Hu, Q. H.*; Williams, M. T.*; Shulgina, I.*; Fossum, C.*; Weeks, K.*; Adams, L.A.*; Reinhardt, C. R.*; Musier-Forsyth K.; Hati, S. †; and Bhattacharyya, S.† “Editing Domain Motions Preorganize the Synthetic Active Site of Prolyl-tRNA Synthetase.” ACS Catal., 2020, 10, 10229-10242 (DOI: https://doi.org/10.1021/acscatal.0c02381).
- Zajac, J.*; Anderson, H.*; Adams, L. A.*; Wangmo, D.*; Suhail, S.*; Almen, A.*; Berns, L.*; Coerber, B.*; Dawson, L.*; Hunger, A.*; Jehn, J.*; Johnson, J.*; Plack, N.*; Strasser, S.*; Williams, M. T.*; Bhattacharyya, S.; and Hati, S.† “Effects of Distal Mutations on Prolyl-adenylate Formation of Escherichia coli Prolyl-tRNA Synthetase”, Protein J., 2020, 39, 542-553. (DOI: https://doi.org/10.1007/s10930-020-09910-3).
- Suhail, S.*; Zajac, Z.*; Fossum, C.*; Lowater, H.*; McCracken, C.*; Severson, N.*; Laatsch, B.*; Narkiewicz-Jodko, A.*; Johnson, B.*; Liebau, J.*; Bhattacharyya, S.; and Hati, S.† “Role of Oxidative Stress on SARS-CoV (SARS) and SARS-CoV-2 (COVID-19) Infection: A Review.” Protein J., 2020, 39(6):644-656 (DOI: https://doi.org/10.1007/s10930-020-09935-8).
- Hati S. and Bhattacharyya, S.† “Impact of Thiol-Disulfide Balance on the Binding of Covid-19 Spike Protein with Angiotensin Converting Enzyme 2 Receptor.” ACS Omega, 2020, 5(26):16292-16298 (DOI: https://doi.org/10.1021/acsomega.0c02125).
- Lewis, D. E.† "The Nazarov Cyclization." Synform 2020/03, A43–A49. (https://www.thieme.de/statics/dokumente/thieme/final/en/dokumente/tw_chemistry/CFZ-Synform-The-Nazarov-Cyclization-NRBio.pdf)
- Lewis, D. E.† "Johann Wilhelm Friedrich Adolf von Baeyer (1835–1917) and Victor Villiger (1868–1934): Peracid Oxidation of Ketones." Synform 2020/12, A173–A178. (https://www.thieme.de/statics/dokumente/thieme/final/en/dokumente/tw_chemistry/CFZ-Synform-Baeyer-Villiger-Reaction-NRBio.pdf)
- Lewis, D. E.† "Yevgenii Konstantinovich Zavoiskii and the battle for EPR." In Strom, E. T.; Mainz, V. V., Eds. Pioneers of Magnetic Resonance; ACS Symp. Ser. 2020, 1349, Ch. 6, pp. 113-122. (DOI: https://doi.org/10.1021/bk-2020-1349.ch006)
2019
- Law, A. C., Stankowski, D. S., Bomann, B. H.*, Suhail, S.*, Salmon, K. H., Paulson, S. W., Carney, M. J.†, Robertson, N. J. “Synthesis and material properties of elastomeric high molecular weight polycycloacetals derived from diglycerol and meso-erythritol” J. Appl. Polym. Sci., 2019, 137, 48780.
- Adams, L. A.*, Andrews, R. J.*, Hu, Q. H.*, Smit, H. L.*, Hati, S. †, and Bhattacharyya, S. † “Crowder-Induced Conformational Ensemble Shift in Escherichia coli Prolyl-tRNA Synthetase.” Biophys. J., 2019, 117, 1269-1284.
- Phillips, J.A. “Modeling Reaction Energies and Exploring Noble Gas Chemistry in the Physical Chemistry Laboratory”, in “Using Computations to Teach Chemical Concepts”, ACS Monograph Series, ACS Publications, 2019.
- Sessions, A. G.*, McDonnell, M. P.*, Christianson, D. A.*, Drucker, S.† “Triplet and Singlet (n,π*) Excited States of 4H‑Pyran-4-one Characterized by Cavity Ring-down Spectroscopy and Quantum-Chemical Calculations,” J. Phys. Chem. 2019, 123, 6269.
- Lewis, D. E.† "Mendeleev, Menshutkin and Beilstein: A new generation takes over." Synform 2019/04, A57–A61. (https://www.thieme.de/statics/dokumente/thieme/final/en/dokumente/tw_chemistry/CFZ-Synform-Mendeleev-Menshutkin-Beilstein-NRBio.pdf)
- Lewis, D. E.† "Carbocation rearrangements: the pinacol, Wagner-Meerwein, Demjanov, and Tiffeneau-Demjanov rearrangements." Synform 2019/08, A121–A127. (https://www.thieme.de/statics/dokumente/thieme/final/en/dokumente/tw_chemistry/CFZ-Synform-Pinacol-Wagner-Meerwein-Demjanov-and-Tiffeneau-Demjanov-Rearrangements-NRB.pdf)
- Lewis, D. E.† "Reaction regiochemistry: Markovnikov, Zaitsev and Hofmann." Synform 2019/11, A172–A179. (https://www.thieme.de/statics/dokumente/thieme/final/en/dokumente/tw_chemistry/CFZ-Synform-Reaction-Regiochemistry-NRBio.pdf)
- Lewis, D. E.† The Wolff-Kishner Reduction and Related Reactions. Discovery and Development. Elsevier: Amsterdam, 2019. https://www.elsevier.com/books/the-wolff-kishner-reduction-and-related-reactions/lewis/978-0-12-815727-5
- Lewis, D. E.† "The minor impurity in spent ores of the "Siberian metal": ruthenium at 175." Chem. Eur. J. 2019, 25, 11394-11401. (DOI: 10.1002/chem.201901922)
- Lewis, D. E.† "Static to dynamic: Kazan chemists and the transformation from chemical structure to reaction regiochemistry." Angew. Chem. Int. Ed. 2019, 58, 3694–3705. (DOI: 10.1002/anie.201804036)
- Lewis, D. E.† "1860-1861: Magic years in the development of the Structural Theory of organic chemistry." Bull. Hist. Chem. 2019, 44, 77–91. http://acshist.scs.illinois.edu/bulletin/FullIssues/vol44-2.pdf
2018
- Reinhardt, C. R.*, Hu, Q. H.*, Bresnahan, C. G.*, Hati, S., Bhattacharyya, S. “Cyclic Changes in Active Site Polarization and Dynamics Drive the ‘Ping-pong’ Kinetics in NRH: Quinone Oxidoreductase 2: An Insight from QM/MM Simulations.” ACS Catal., 2018, 8 (12), 12015–12029 (DOI: https://doi.org/10.1021/acscatal.8b04193).
- Hati S. and Bhattacharyya, S. “Integrating Research into the Curriculum – A Low-cost Strategy for Promoting Undergraduate Research”, ACS Book Chapter (Book: Best Practices for Supporting and Expanding Undergraduate Research in Chemistry), 2018, 119–141.
- McNider, R. T., Pour-Biazar, A., Doty, K., White, A., Wu, Y., Qin, M., Hu, Y., Odman, T., Cleary, P., Knipping, E., Dornblaser, B., Lee, P., Hain, C., McKeen, S. “Examination of the Physical Atmosphere in the Great Lakes Region and Its Potential Impact on Air Quality—Overwater Stability and Satellite Assimilation”, Journal of Applied Meteorology and Climatology, 2018, 57(12), 2789-2816. (DOI: https://doi.org/10.1175/JAMC-D-17-0355.1).
- Zhang, J.*, Fischer, C.*, Oster, J.*, Mooney, R.*, Chaves, J. D. C.*, Cleary, P. A.† “Characterization of Ambient Particle Matter Sampled at an Active Sand Mine Facility in Northwestern Wisconsin”, American Journal of Undergraduate Research, 2018, 15, 2.
- N.J. Hora,* B.M. Wahl,* C. Soares,* S.A. Lara,* J.R. Lanska,* and J.A. Phillips† “On the Interactions of Nitriles and Fluoro-Substituted Pyridines with Silicon Tetrafluoride: Computations and Thin Film IR Spectroscopy”, J. Molec. Struct. 2018, 1157, 679.
- Lewis, D. E.† "Charles Friedel (1832-1899) and James Mason Crafts (1839-1917): the Friedel-Crafts Alkylation and Acylation Reactions." Synform 2018/4, A49–A53. https://www.thieme.de/statics/bilder/thieme/final/en/bilder/tw_chemistry/CFZ-Synform-Charles-Friedel-James-Crafts-NRBio.pdf
- Lewis, D. E.† "Rearrangement to electron-deficient nitrogen. 1. A. W. Hofmann (1818-1892), W. Lossen (1838-1906), and T. Curtius (1857-1928)." Synform 2018/7, A107–A110. https://www.thieme.de/statics/dokumente/thieme/final/en/dokumente/tw_chemistry/CFZ-Synform-Hofmann-Lossen-Curtius-NRBio.pdf
- Dieringer, R. K.*; Hunter, H. K.*; Lewis, D. E.†, “Philippe Barbier (1848-1922) and Victor Grignard (1871-1935): Pioneers of organomagnesium chemistry.” Synform 2018/10, A155–A159. https://www.thieme.de/statics/dokumente/thieme/final/en/dokumente/tw_chemistry/CFZ-Synform-Philippe-Barbier-Victor-Grignard-NRBio.pdf
- Lewis, D. E.† "High creativity and historical invisibility: The rise of a chemical community in Russia." In Rasmussen, S.C., Ed. Igniting the Ring of Fire: Historical Evolution of the Chemical Communities in the Countries of the Pacific Rim. (World Scientific Publishing: Singapore, 2018); Ch. 11, pp. 309–354.
- Lewis, D. E.† "Introduction to an English translation of Markovnikov's first paper describing 'Markovnikov's Rule.'" Bull. Hist. Chem. 2018, 43, 21–23. (http://acshist.scs.illinois.edu/bulletin_open_access/FullIssues/vol43-1.pdf)
- Lewis, D. E.† "Primary Documents. 'On the question of the mutual influence of atoms in chemical compounds.' V. Morkovnikov. Zhurnal Russkago Fiziko-Khimicheskago Obshchestva, 1869, 1, 242-247." Translated by David E. Lewis. Bull. Hist. Chem. 2018, 43, 24–26. (http://acshist.scs.illinois.edu/bulletin_open_access/FullIssues/vol43-1.pdf)
2017
- Meeuwsen, S.*, Adams, L. M.*, Hodac, A. N., * McMunn, R. D.*, Maxwell, A. S.*, Carothers, K. J.*, Egdorf, R. E.*, Hanneman, P. M.*, Kitzrow, J. P.*, Keonigsberg, C. K.*, Lopez-Martinez, O.*, Matthew, P. A. *, Richter, E. H.*, Schenk, J. E.*, Schmit, H. L.*, Scott, M. A.*, Volenec, E. M.*, and Hati, S. “Investigation of Intrinsic Dynamics of Enzymes Involved in Metabolic Pathways using Coarse-grained Normal Mode Analysis” Cogent Biology, 2017, 3, 1291877 (open access).
- Mitchell, S.*, Lato, A.*, Hurst, O.*, Adams, L.*, Dahl, J. and Sanchita Hati† “Nanoparticles and Escherichia coli prolyl-tRNA synthetase: Impact of Au and Ag nanoparticles on protein conformation and function”, Curr. Top. Pept. Protein. Res. 2017, 18, 17-24.
- Fehling, S. C.*, Strom, A. M.*, Lehman, B. P.*, Andrews, R. J.*, Bhattacharyya, S. and Hati, S.† “A Comparative Study of All-atom Molecular Dynamics Simulation and Coarse-grained Normal Mode Analysis in Identifying Pre-existing Residue Interaction Networks that Promote Coupled-Domain Dynamics in Escherichia coli Methionyl-tRNA Synthetase”, American J. of Undergraduate Research, 2017, 14, 27-44.
- Hintz, H. A.*; Sortedahl, N. J.*; Meyer, S. M.*; Decato, D. A.*; Dahl, B. J. † “The Synthesis of Lactone-Bridged 1,3,5-Triphenylbenzene Derivatives as Pi-Expanded Coumarin Triskelions.” Tetrahedron Lett. 2017, 58, 4703-4708 (DOI: 0.1016/j.tetlet.2017.11.010).
- Mooneyham, A. E.*; McDonnell, M. P.*; Drucker, S. † “Cavity Ringdown Spectrum of 2‑Cyclohexen-1-one in the CO/Alkenyl CC Stretch Region of the S1(n,π*) − S0 Vibronic Band System”, J. Phys. Chem. 2017, 121, 2343.
- J.A. Phillips, S.J. Danforth, N.J. Hora, J.R. Lanska, and A.W. Waller “Structural and Energetic Properties of Haloacetonitrile–BCl3 Complexes: Computations and Matrix-IR Spectroscopy”, J. Phys. Chem. A 2017, 121, 9252–9261.
- Deiringer, R. K.*; Lewis, D. E.† "Arthur Michael (1853–1942): The Michael Addition Reaction." Synform, 2017/09, A142–144. https://www.thieme.de/statics/dokumente/thieme/final/en/dokumente/tw_chemistry/CFZ-Synform-Arthur-Michael-The-Michael-Addition-Reaction-NRBio.pdf
- Lewis, D. E.† "Independent Discoveries: The Wolff-Kishner Reduction." Synform, 2017/12, A208-A212. https://www.thieme.de/statics/bilder/thieme/final/en/bilder/tw_chemistry/CFZ-Synform-Independent-Discoveries-The-Wolff-Kishner-Reduction-NRBio.pdf
- Lewis, D. E.† "Yevgenii Konstantinovich Zavoiskii (1907-1976): Overlooked Pioneer in Magnetic Resonance." In Strom, E. T.; Mainz, V. V., Eds. The Posthumous Nobel Prize in Chemistry: Correcting the Errors & Oversights of the Nobel Prize Committee. ACS Symp. Ser. 2017, 1262, Ch. 10, pp. 219–241. (DOI: http://pubs.acs.org/isbn/9780841232518)
- Lewis, D. E.† "A. Ye. Arbuzov: Father of organophosphorus chemistry in Russia." Bull. Hist. Chem., 2017, 42, 112–125. (http://www.scs.illinois.edu/~mainzv/HIST/bulletin/v42-2/v42-2%20p112-125.pdf)
- Lewis, D. E.† "Aleksei Yevgen'evich Chichibabin (1871-1945): A century of pyridine chemistry" Angew. Chem. Int. Ed. 2017, 56, 9660–9668 (DOI: 10.1002/anie.201611724);
- Lewis, D. E.† “Alexei Jewgenjewitsch Tschitschibabin (1871–1945): ein Jahrhundert Pyridinchemie Angew. Chem. 2017, 129, 9788–9796. (DOI: 10.1002/ange.201611724)
- Suntsov, V.*; Lewis, D. E.† "After the Revolution: Nikolai Matveevich Kizhner (1867-1935) in Soviet Moscow." Bull. Hist. Chem. 2017, 42, 46–56. (http://www.scs.illinois.edu/~mainzv/HIST/bulletin/v42-1/vol42-1%20p46-56.pdf)
- Anderson, S. M.*; Mitchell, S. D.*; LaPlante, K. A.*; McKenney, R. K.*; Lewis, D. E.† "General acid and base catalysis in transamination of 6-chloro-2-aryl-1H-benz[de]isoquinoline-1,3-(2H)-dione and its implications in laser tissue welding." J. Heterocycl. Chem. 2017, 54, 2029–2037. (DOI: http://doi.org/10.1002/jhet.2800)
- Lewis, D. E.† "Intramolecular pericyclic reactions of acetylene derivatives leading to dehydroaromatic and related species." Minirev. Org. Chem. 2017, 14, 107–121. (DOI: http://www.eurekaselect.com/149807/article)
2016
- Weiss, N. M. *, Waller, A. W. *, and Phillips, J. A. † “Infrared spectrum of CH3CN–HCl in solid neon, and modeling matrix effects in CH3CN–HCl and H3N–HCl”. J. Mol. Struc., 2016, 1105, 341–349.
- Reinhardt*, C. R., Jaglinski*, T. C., Kastenschmidt*, A. M., Song*, E. H., Gross*, A. K., Krause*, A. J., Gollmar*, J. M., Meise*, K. J., Stenerson*, Z. S., Weibel*, T. J., Dison*, A., Finnegan*, M. R., Griesi*, D. S., Heltne*, M. D., Hughes*, T. G., Hunt*, C. D., Jansen*, K. A., Xiong*, A. H., Hati, S., and Bhattacharyay, S. (2016) Insight into the kinetics and thermodynamics of the hydride transfer reactions between quinones and lumiflavin: a density functional theory study. J Mol Model 22, 199.
- Weiss*, N. M., Waller*, A. W., and Phillips, J. A. (2016) Infrared spectrum of CH3CN–HCl in solid neon, and modeling matrix effects in CH3CN–HCl and H3N–HCl. Journal of Molecular Structure 1105, 341–349.
- Leong*, C. H., Porras, I., and King, F. W. (2016) Analysis of atomic integrals involving explicit correlation factors for the three-electron case. I. Connection to the hypergeometric function 3F2. J Math Chem 54, 1514–1552.
- King, F. W. (2016) The evaluation of some four-electron correlated integrals with a Slater basis arising in linear and nonlinear r12 theories. Journal of Physics B: Atomic, Molecular and Optical Physics 49, 105001.
- Hati, S., and Bhattacharyya, S. (2016) Incorporating modeling and simulations in undergraduate biophysical chemistry course to promote understanding of structure-dynamics-function relationships in proteins: Biophysical Chemistry Laboratory Course. Biochemistry and Molecular Biology Education 44, 140–159.
- DiSpirito, A. A., Semrau, J. D., Murrell, J. C., Gallagher, W. H., Dennison, C., and Vuilleumier, S. (2016) Methanobactin and the Link between Copper and Bacterial Methane Oxidation. Microbiology and Molecular Biology Reviews 80, 387–409.
2015
- Suntsov*, V., and Lewis, D. E. (2015) Introduction to an English translation of Kizhner’s pioneering papers on deoxygenation. Bull. Hist. Chem 40, 61–73.
- Lewis, D. E. (2015) Introduction to an english translation, “On the different explanations of certain cases of isomerism” by Alexsandr Butlerov. Bull. Hist. Chem 40, 9–28,61–73.
- Lewis, D. E. (2015) Advanced Organic Chemistry. Oxford University Press, New York.
- Laskowski*, A. E., Decato*, D. A., Strandwitz*, M. S., and Dahl, J. A. (2015) Microwave synthesis of a bimodal mixture of triangular plate and spheroidal silver nanoparticles. MRS Communications 5, 311–317.
- Dressler*, J. J., Miller*, S. A., Meeuwsen*, B. T., Riel*, A. M. S., and Dahl, B. J. (2015) Synthesis of dilactone bridged terphenyls with crankshaft architectures. Tetrahedron 71, 283–292.
- Dorner*, M. E., McMunn*, R. D., Bartholow*, T. G., Calhoon*, B. E., Conlon*, M. R., Dulli*, J. M., Fehling*, S. C., Fisher*, C. R., Hodgson*, S. W., Keenan*, S. W., Kruger*, A. N., Mabin*, J. W., Mazula*, D. L., Monte*, C. A., Olthafer*, A., Sexton*, A. E., Soderholm*, B. R., Strom*, A. M., and Hati, S. (2015) Comparison of intrinsic dynamics of cytochrome p450 proteins using normal mode analysis. Protein Science 24, 1495–1507.
- Cleary, P. A., Fuhrman*, N., Schulz, L., Schafer, J., Fillingham, J., Bootsma, H., McQueen, J., Tang, Y., Langel, T., McKeen, S., Williams, E. J., and Brown, S. S. (2015) Ozone distributions over southern Lake Michigan: comparisons between ferry-based observations, shoreline-based DOAS observations and model forecasts. Atmos. Chem. Phys. 15, 5109–5122.
- Bresnahan*, C. G., Reinhardt*, C. R., Bartholow*, T. G., Rumpel*, J. P., North*, M., and Bhattacharyya, S. (2015) Effect of stacking interactions on the thermodynamics and kinetics of lumiflavin: a study with improved density functionals and density functional tight-binding protocol. The Journal of Physical Chemistry A 119, 172–182.
2014
- Wrass*, J. P., Sadowsky, D., Bloomgren*, K. M., Cramer, C. J., and Phillips, J. A. (2014) Quantum chemical and matrix-IR characterization of CH3CN–BCl3: a complex with two distinct minima along the B–N bond potential. Physical Chemistry Chemical Physics 16, 16480–16491.
- Warren*, N., Strom*, A., Nicolet*, B., Albin*, K., Albrecht*, J., Bausch*, B., Dobbe*, M., Dudek*, M., Firgens*, S., Fritsche*, C., Gunderson*, A., Heimann*, J., Her*, C., Hurt*, J., Konorev*, D., Lively*, M., Meacham*, S., Rodriguez*, V., Tadayon*, S., Trcka*, D., Yer*, Y., Bhattacharyya, S., and Hati, S. (2014) Comparison of the intrinsic dynamics of aminoacyl-tRNA synthetases. The protein journal 33, 184–198.
- Suntsov*, V., and Lewis, D. E. (2014) A century of base-promoted decomposition of hydrazones: the Tomsk years of Nikolai Matveevich Kizhner (1867-1935. Bull. Hist. Chem 39, 43–52.
- Strom*, A. M., Fehling*, S. C., Bhattacharyya, S., and Hati, S. (2014) Probing the global and local dynamics of aminoacyl-tRNA synthetases using all-atom and coarse-grained simulations. Journal of molecular modeling 20, 1–11.
- Sanders II*, T. A., Sauceda*, M. N., and Dahl, J. A. (2014) Langmuir isotherms of flexible, covalently crosslinked gold nanoparticle networks: Increased collapse pressures of membrane-like structures. Materials Letters 120, 159–162.
- Lewis, D. E. (2014) Citations for Chemical Breakthroughs: Mendeleev’s Periodic System of the Elements. Bull. Hist. Chem 39, 1–6.
- Krall, E. M., Klein, T. W., Andersen, R. J., Nett*, A. J., Glasgow*, R. W., Reader, D. S., Dauphinais, B. C., Ilrath, S. P. M., Fischer*, A. A., Carney, M. J., Hudson, D. J., and Robertson, N. J. (2014) Controlled hydrogenative depolymerization of polyesters and polycarbonates catalyzed by ruthenium(II) PNN pincer complexes. Chem. Commun. 50, 4884–4887.
- King, F. W. (2014) On the evaluation of four-electron correlated integrals with a Slater basis: some simplifications and some closed form examples. Journal of Physics B: Atomic, Molecular and Optical Physics 47, 025003.
- Helminiak*, H. M., Knauf*, R. R., Danforth*, S. J., and Phillips, J. A. (2014) Structural and Energetic Properties of Acetonitrile–Group IV (A & B) Halide Complexes. The Journal of Physical Chemistry A 118, 4266–4277.
- Bartholow*, T. G., Sanford*, B. L., Cao*, B., Schmit*, H. L., Johnson*, J. M., Meitzner*, J., Bhattacharyya, S., Musier-Forsyth, K., and Hati, S. (2014) Strictly conserved lysine of prolyl-tRNA synthetase editing domain facilitates binding and positioning of misacylated tRNAPro. Biochemistry 53, 1059–1068.
2013
- McKenney*, R. K., Groess*, L. L., Kopidlansky*, K. M., Dunkle*, K. L., and Lewis, D. E. (2013) The heterocyclic ring of 4-substituted-1,8-naphthalimides is NOT inert to nucleophilic attack, contrary to earlier reports. Org. Biomol. Chem. 11, 4390–4396.
- McAnally*, M. O., Zabronsky*, K. L., Stupca*, D. J., Phillipson*, K., Pillsbury*, N. R., and Drucker, S. (2013) Lowest triplet (n,π*) state of 2-cyclohexen-1-one: Characterization by cavity ringdown spectroscopy and quantum-chemical calculations. The Journal of Chemical Physics 139, 214311.
- Lewis, D. E. (2013) Yegor Yegorovich Vagner (1849-1903): A “Wondrously Sharpwitted” Chemist. ACS symposium series 1136, 143–165.
- Lewis, D. E. (2013) Disability, Despotism, Deoxygenation—From Exile to Academy Member: Nikolai Matveevich Kizhner. Angew. Chem. Int. Ed. 52, 11704–11712.
- King, F. W. (2013) High-precision calculations of the hyperfine constants and some selected transition energies for the low-lying 4S levels of the lithium atom. International Journal of Quantum Chemistry 113, 2534–2539.
- Johnson*, J. M., Sanford*, B. L., Strom*, A. M., Tadayon*, S. N., Lehman*, B. P., Zirbes*, A. M., Bhattacharyya, S., Musier-Forsyth, K., and Hati, S. (2013) Multiple pathways promote dynamical coupling between catalytic domains in Escherichia coli prolyl-tRNA synthetase. Biochemistry 52, 4399–4412.
- Hlavacek*, N. C., McAnally*, M. O., and Drucker, S. (2013) Lowest triplet (n, π*) electronic state of acrolein: Determination of structural parameters by cavity ringdown spectroscopy and quantum-chemical methods. The Journal of Chemical Physics 138, 064303.
- Her*, C., Westler, W. M., and Yang, T. (2013) Significance of Proline Residue on Short Mucin Peptide Interactions with Mouse MUC1 Monoclonal Antibody Studied by Saturation Transfer Difference NMR Spectroscopy. JSM Chem 1.
- Buchberger*, A. R., Danforth*, S. J., Bloomgren*, K. M., Rohde*, J. A., Smith*, E. L., Gardener*, C. C., and Phillips, J. A. (2013) Condensed-Phase Effects on the Structural Properties of FCH2CN–BF3 and ClCH2CN–BF3: A Matrix-Isolation and Computational Study. The Journal of Physical Chemistry B 117, 11687–11696.
2012
- Young Jr, V. G., Henderson, W. A., and Carney, M. J. (2012) Enantiotropic Serendipity: Using DSC to Assist in the Data Acquisition of Otherwise Routine Single Crystal Diffraction Experiments, in American Crystallographic Association Annual Meeting. Boston, MA.
- Sydora, O. L., Jones*, T. C., Small, B. L., Nett*, A. J., Fischer*, A. A., and Carney, M. J. (2012) Selective Ethylene Tri-/Tetramerization Catalysts. ACS Catalysis 2, 2452–2455.
- Schiedler, S., Peterson, R., Showsh, S., and Yang, T. (2012) Determining the Efficacy of IonatorEXPTM Activated Tap Water on Growth of Staphylococcus aures and Escherichia coli. American J. Undergrad. Res. 10, 11–18.
- Sanford*, B., Cao*, B., Johnson*, J. M., Zimmerman*, K., Strom*, A. M., Mueller*, R. M., Bhattacharyya, S., Musier-Forsyth, K., and Hati, S. (2012) Role of coupled dynamics in the catalytic activity of prokaryotic-like prolyl-tRNA synthetases. Biochemistry 51, 2146–2156.
- Prust*, E. E., Carlson*, E. J., and Dahl, B. J. (2012) 6-Aryldibenzo[b,d]pyrylium salts: synthesis and characterization of a reversible pH-driven optical and spectroscopic response. Tetrahedron Letters 53, 6433–6435.
- Liu, X.-T., Schwan, W. R., Volk, T. J., Rott, M., Liu, M., Huang, P., Liu, Z., Wang, Y., Zitomer, N. C., Sleger, C., Hartsel, S., Monte, A., and Zhang, L. (2012) Antibacterial Spirobisnaphthalenes from the North American Cup Fungus Urnula craterium. Journal of Natural Products 75, 1534–1538.
- Lewis, D. E. (2012) Early Russian organic chemists and their legacy (Rasmussen, S., Ed.). Springer: Heidelberg.
- Knauf*, R. R., Helminiak*, H. M., Wrass*, J. P., Gallert*, T. M., and Phillips, J. A. (2012) Structural and energetic properties of alkylfluoride-BF3 complexes in the gas phase and condensed-phase media: computations and matrix infrared spectroscopy. Journal of Physical Organic Chemistry 25, 493–501.
- Janssen*, E. L., Salazar*, I. E., Friday, S. R., and Wiegel, K. N. (2012) Supramolecular main-chain liquid crystalline polymers and networks with competitive hydrogen bonding: flexible bis-cinnamic acids as hydrogen bond donors in thermoreversible networks and polymers. Liquid Crystals 39, 857–863.
- Fredrickson*, D. D., Hilberg*, B. A., Lasure*, K. K., Tessner*, J. D., Waner*, A. E., Zenner*, M. D., and Wiegel, K. N. (2012) Supramolecular main-chain liquid crystalline polymers and networks with competitive hydrogen bonding: a study of rigid networking agents in supramolecular systems. Liquid Crystals 39, 1243–1251.
- Carlson*, E. J., Riel*, A. M. S., and Dahl, B. J. (2012) Donor–acceptor biaryl lactones: pH induced molecular switches with intramolecular charge transfer modulation. Tetrahedron Letters 53, 6245–6249.
- Bandow, N., Gilles, V. S., Freesmeier, B., Semrau, J. D., Krentz*, B., Gallagher, W., McEllistrem, M. T., Hartsel, S. C., Choi, D. W., Hargrove, M. S., Heard*, T. M., Chesner*, L. N., Braunreiter*, K. M., Cao*, B. V., Gavitt*, M. M., Hoopes*, J. Z., Johnson*, J. M., Polster*, E. M., Schoenick*, B. D., Umlauf*, A. M., and Dispirito, A. A. (2012) Spectral and copper binding properties of methanobactin from the facultative methanotroph Methylocystis strain SB2. J Inorg Biochem 110, 72–82.
2011
- Smith*, E. L., Sadowsky, D., Cramer, C. J., and Phillips, J. A. (2011) Structure, bonding, and energetic properties of nitrile-borane complexes: RCN-BH3. J Phys Chem A 115, 1955–1963.
- Porras, I., Schuster*, C. D., and King, F. W. (2011) Convergence Accelerator Approach to the Numerical Evaluation of Hilbert Transforms Based on Expansions in Hermite Functions. IAENG International Journal of Applied Mathematics 41, 252–259.
- Porras, I., Schuster*, C. D., and King, F. W. (2011) Combined eigenfunction expansion and convergence accelerator approach to the rapid numerical evaluation of Hilbert transforms. Proc. of the World Congress on Engineering 1, 1–6.
- Mueller*, R. M., North*, M. A., Yang*, C., Hati, S., and Bhattacharyya, S. (2011) Interplay of flavin’s redox states and protein dynamics: an insight from QM/MM simulations of dihydronicotinamide riboside quinone oxidoreductase 2. J Phys Chem B 115, 3632–3641.
- Morales, C. M., and Thompson, W. H. (2011) Molecular-level mechanisms of vibrational frequency shifts in a polar liquid. J Phys Chem B 115, 7597–7605.
- Mills, N. S., Cheng, F. E., Baylan, J. M., Tirla, C., Hartmann, J. L., Patel, K. C., Dahl, B. J., and McClintock, S. P. (2011) Dictions of 3-Phenyl-indenylidene Dibenzo[ a . d ]cycloheptene: The Role of Charge in the Antiaromaticity of Cationic Systems. The Journal of Organic Chemistry 76, 645–653.
- Miesen*, R. F., Friday*, S. R., and Wiegel, K. N. (2011) Supramolecular main-chain liquid crystalline polymers and networks with competitive hydrogen bonding: a study of flexible bis-acids and a mixture of rigid and flexible polypyridyls. Liquid Crystals 38, 1341–1347.
- Lewis, D. E. (2011) A. M. Zaitsev: Lasting Contributions of a Synthetic Virtuoso a Century after his Death. Angew. Chem. Int. Ed. 50, 6452–6458.
- King, F. W., Quicker*, D., and Langer*, J. (2011) Compact wave functions for the beryllium isoelectronic series, Li− to Ne6+: A standard Hylleraas approach. The Journal of Chemical Physics 134, 124114.
- Hammers*, M. D., Wichman*, J. J., and Wiegel, K. N. (2011) Supramolecular main-chain liquid crystalline polymers and networks with competitive hydrogen bonding: a study of increased flexibility on distonic mesogenic hydrogen bond acceptors with networks created from tetrakis-, tris-and bis-functionalised pyridyl networking agents. Liquid Crystals 38, 581–587.
- Bandow, N. L., Gallagher, W. H., Behling*, L., Choi, D. W., Semrau, J. D., Hartsel, S. C., Gilles, V. S., and DiSpirito, A. A. (2011) Chapter seventeen - Isolation of Methanobactin from the Spent Media of Methane-Oxidizing Bacteria, in Methods in Enzymology (Ragsdale, A. C. R. and S. W., Ed.), pp 259–269. Academic Press.
2010
- Stromich*, J. J., Weber*, A. K., Mirzaei, Y. R., Caldwell, M. D., and Lewis, D. E. (2010) New adjuvants to enhance anticoagulant activity of warfarin. Bioorganic & medicinal chemistry letters 20, 1928–1932.
- Smith*, E. L., Sadowsky, D., Phillips, J. A., Cramer, C. J., and Giesen, D. J. (2010) A short yet very weak dative bond: structure, bonding, and energetic properties of N2-BH3. J Phys Chem A 114, 2628–2636.
- Small, B. L., Rios, R., Fernandez, E. R., Gerlach*, D. L., Halfen, J. A., and Carney, M. J. (2010) Oligomerization of Ethylene Using New Tridentate Iron Catalysts Bearing α-Diimine Ligands with Pendant S and P Donors. Organometallics 29, 6723–6731.
- North*, M. A., Bhattacharyya, S., and Truhlar, D. G. (2010) Improved density functional description of the electrochemistry and structure-property descriptors of substituted flavins. J Phys Chem B 114, 14907–14915.
- McDonald, A. R., Bukowski, M. R., Farquhar, E. R., Jackson, T. A., Koehntop, K. D., Seo, M. S., De Hont, R. F., Stubna, A., Halfen, J. A., Münck, E., Nam, W., and Que, L. (2010) Sulfur versus iron oxidation in an iron-thiolate model complex. J. Am. Chem. Soc. 132, 17118–17129.
- Lewis, D. E. (2010) Feuding Rule-Makers: Vladimir Vasil’evich Markovnikov (1838-1904) and Aleksandr Mikhailovich Zaitsev (1841-1910). A Commentary on the Origins of Zaitsev’s Rule. Bull. Hist. Chem 35, 115–124.
- Lewis, D. E. (2010) The protocenter concept: A method for teaching stereochemistry. Journal of Chemical Education 87, 604–607.
- Lewis, D. E. (2010) 150 Years of Organic Structures. ACS symposium series 1044, 35–57.
- Krentz*, B. D., Mulheron*, H. J., Semrau, J. D., Di Spirito, A. A., Bandow, N. L., Haft, D. H., Vuilleumier, S., Murrell, J. C., McEllistrem, M. T., Hartsel, S. C., and Gallagher, W. H. (2010) A Comparison of Methanobactins from Methylosinus trichosporium OB3b and Methylocystis Strain SB2 Predicts Methanobactins Are Synthesized from Diverse Peptide Precursors Modified To Create a Common Core for Binding and Reducing Copper Ions. Biochemistry 49, 10117–10130.
- Grubel, K., Rudzka, K., Arif, A. M., Klotz*, K. L., Halfen, J. A., and Berreau, L. M. (2010) Synthesis, characterization, and ligand exchange reactivity of a series of first row divalent metal 3-hydroxyflavonolate complexes. Inorg Chem 49, 82–96.
- Greuel*, J. R., Witte*, D. K., Morales, C. M., and Wiegel, K. N. (2010) Supramolecular main-chain liquid crystalline polymers and networks with competitive hydrogen bonding. Liquid Crystals 37, 1127–1131.
- Greuel*, J. R., Andrews*, T. E., Wichman*, J. J., Tessner*, J. D., and Wiegel, K. N. (2010) Supramolecular main-chain liquid crystalline polymers and networks with competitive hydrogen bonding: networks and linear polymers created from tris- and bis-functionalised pyridyl networking agents. Liquid Crystals 37, 1515–1520.
- Choi, D. W., Bandow, N. L., McEllistrem, M. T., Semrau, J. D., Antholine, W. E., Hartsel, S. C., Gallagher, W., Zea, C. J., Pohl, N. L., Zahn, J. A., and DiSpirito, A. A. (2010) Spectral and thermodynamic properties of methanobactin from gamma-proteobacterial methane oxidizing bacteria: a case for copper competition on a molecular level. J Inorg Biochem 104, 1240–7.
2009
- Weimer*, K. M. E., Shane*, B. L., Brunetto*, M., Bhattacharyya, S., and Hati, S. (2009) Evolutionary Basis for the Coupled-domain Motions in Thermus thermophilus Leucyl-tRNA Synthetase. J. Biol. Chem. 284, 10088–10099.
- Springer*, M. G., Hlavacek*, N. C., Jagusch*, S. P., Johnson*, A. R., and Drucker, S. (2009) Cavity ringdown spectrum of the T(1)(n,pi*) <-- S(0) transition of 4-cyclopentene-1,3-dione. J Phys Chem A 113, 13318–13326.
- Ruiz-Pernía, J. J., Garcia-Viloca, M., Bhattacharyya, S., Gao, J., Truhlar, D. G., and Tuñón, I. (2009) Critical role of substrate conformational change in the proton transfer process catalyzed by 4-oxalocrotonate tautomerase. J. Am. Chem. Soc. 131, 2687–2698.
- Rauschnot*, J. C., Yang*, C., Yang*, V., and Bhattacharyya, S. (2009) Theoretical Determination of the Redox Potentials of NRH:Quinone Oxidoreductase 2 Using Quantum Mechanical/Molecular Mechanical Simulations. J. Phys. Chem. B 113, 8149–8157.
- Klotz*, K. L., Slominski*, L. M., Riemer*, M. E., Phillips, J. A., and Halfen, J. A. (2009) Mechanism of the Iron-Mediated Alkene Aziridination Reaction: Experimental and Computational Investigations. Inorganic Chemistry 48, 801–803.
- King, F. W. (2009) Hilbert Transforms: Volume 2. Cambridge University Press, Cambridge Eng. ; New York.
- King, F. W. (2009) Hilbert Transforms: Volume 1. Cambridge University Press.
- King, F. W. (2009) High-precision calculations of the hyperfine constants for the low-lying excited 2S States of Be+. J Phys Chem A 113, 4110–4116.
- Eigner*, A. A., Wrass*, J. P., Smith*, E. L., Knutson*, C. C., and Phillips, J. A. (2009) Structural properties of CH3CN–SO2 in the gas phase and condensed-phase media via density functional theory and infrared spectroscopy. Journal of Molecular Structure 919, 312–320.
- Doering*, S. R., Strobush*, K. M., Marschall, J., and Boulter, J. E. (2009) The effect of microwave-frequency discharge-activated oxygen on the microscale structure of low-temperature water ice films. The Journal of Chemical Physics 131, 224706.
2008
- Zhou, Y., Shan, X., Mas-Ballesté, R., Bukowski, M. R., Stubna, A., Chakrabarti, M., Slominski*, L., Halfen, J. A., Münck, E., and Que, L. (2008) Contrasting cis and trans Effects on the Reactivity of Nonheme Oxoiron(IV) Complexes. Angewandte Chemie International Edition 47, 1896–1899.
- Rishard, M. Z. M., Brown*, E. A., Ausman*, L. K., Drucker, S., Choo, J., and Laane, J. (2008) Ultraviolet cavity ringdown spectra and the S1(n,pi) ring-inversion potential energy function for 2-cyclohexen-1-one-d0 and Its 2,6,6-d3 isotopomer. J Phys Chem A 112, 38–44.
- King, F. W. (2008) One-center Slater-type integrals with explicit correlation factors., in Recent advances in computational chemistry: molecular integrals over slater orbitals, pp 39–84. Transworld Research Network, Trivandrum.
- Hoffelt*, L. M., Springer*, M. G., and Drucker, S. (2008) Phosphorescence excitation spectrum of the T1(n,π*)←S0 transition of 4H-pyran-4-one. The Journal of Chemical Physics 128, 104312.
- Feldmann*, D. M., and King, F. W. (2008) Upper bound to the critical binding nuclear charge for a three-electron atomic system. J. Phys. B: At. Mol. Opt. Phys. 41, 025002.
- Emmert III*, F. L., Thomas*, J., Hon*, B., and Gengenbach, A. J. (2008) Metalloporphyrin catalyzed oxidation of methyl yellow and related azo compounds. Inorganica Chimica Acta 361, 2243–2251.
- Eierman, R. J. (2008) The Teaching Philosophy Statement: Purposes and Organizational Structure. J. Chem. Educ. 85, 336.
- Choi, D. W., Semrau, J. D., Antholine, W. E., Hartsel, S. C., Anderson, R. C., Carey, J. N., Dreis, A. M., Kenseth, E. M., Renstrom, J. M., Scardino*, L. L., Van Gorden*, G. S., Volkert*, A. A., Wingad*, A. D., Yanzer*, P. J., McEllistrem, M. T., de la Mora, A. M., and DiSpirito, A. A. (2008) Oxidase, superoxide dismutase, and hydrogen peroxide reductase activities of methanobactin from types I and II methanotrophs. Journal of Inorganic Biochemistry 102, 1571–1580.
- Behling*, L. A., Hartsel, S. C., Lewis, D. E., DiSpirito, A. A., Choi, D. W., Masterson, L. R., Veglia, G., and Gallagher, W. H. (2008) NMR, mass spectrometry and chemical evidence reveal a different chemical structure for methanobactin that contains oxazolone rings. J Am Chem Soc 130, 12604–5.
2007
- Small, B. L., Rios, R., Fernandez, E. R., and Carney, M. J. (2007) Oligomerization of Ethylene Using New Iron Catalysts Bearing Pendant Donor Modified α-Diimine Ligands. Organometallics 26, 1744–1749.
- Schmiege*, B. M., Carney, M. J., Small, B. L., Gerlach*, D. L., and Halfen, J. A. (2007) Alternatives to pyridinediimine ligands: syntheses and structures of metal complexes supported by donor-modified α-diimine ligands. Dalton Trans. 2547–2562.
- Sastri, C. V., Lee, J., Oh, K., Lee, Y. J., Lee, J., Jackson, T. A., Ray, K., Hirao, H., Shin, W., Halfen, J. A., Kim, J., Que, L., Shaik, S., and Nam, W. (2007) Axial ligand tuning of a nonheme iron(IV)-oxo unit for hydrogen atom abstraction. Proc. Natl. Acad. Sci. U.S.A. 104, 19181–19186.
- Pillsbury*, N. R., Zwier, T. S., Judge, R. H., and Drucker, S. (2007) Jet-cooled phosphorescence excitation spectrum of the T1(n,pi*) <-- S0 transition of 2-cyclopenten-1-one. J Phys Chem A 111, 8357–8366.
- Phillips, J. A., and Cramer, C. J. (2007) B-N distance potential of CH3CN-BF3 revisited: resolving the experiment-theory structure discrepancy and modeling the effects of low-dielectric environments. J Phys Chem B 111, 1408–1415.
- Krogstad, D. A., Ellis, G. S., Gunderson, A. K., Hammrich, A. J., Rudolf, J. W., and Halfen, J. A. (2007) Two new water-soluble derivatives of 1,3,5-triaza-7-phosphaadamantane (PTA): Synthesis, characterization, X-ray analysis and solubility studies of 3,7-diformyl-1,3,7-triaza-5-phosphabicyclo[3.3.1]nonane and 1-pyridylmethyl-3,5-diaza-1-azonia-7-phosphatricyclo[3.3.1.1]decane bromide. Polyhedron 26, 4093–4100.
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