All Faculty and Research Staff Publications

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Vinokur AI, Fredrickson DC. 18-Electron Resonance Structures in the BCC Transition Metals and Their CsCl-type Derivatives. Inorganic Chemistry. 2017 ;56:2834-2842.
Huang X, Bennett JW, Hang MMN, Laudadio ED, Hamers RJ, Mason SE. Ab Initio Atomistic Thermodynamics Study of the (001) Surface of LiCoO2 in a Water Environment and Implications for Reactivity under Ambient Conditions. Journal of Physical Chemistry C. 2017 ;121:5069-5080.
Jaskula-Sztul R, Chen GJ, Dammalapati A, Harrison A, Tang WP, Gong SQ, Chen H. AB3-loaded and tumor-targeted unimolecular micelles for medullary thyroid cancer treatment. Journal of Materials Chemistry B. 2017 ;5:151-159.
Kratochvil MJ, Carter MCD, Lynn DM. Amine-Reactive Azlactone-Containing Nanofibers for the Immobilization and Patterning of New Functionality on Nanofiber-Based Scaffolds. ACS Applied Materials & Interfaces. 2017 ;9:10243-10253.
Liu W, Liu H, Dang LN, Zhang HX, Wu XL, Yang B, Li ZJ, Zhang XW, Lei LC, Jin S. Amorphous Cobalt-Iron Hydroxide Nanosheet Electrocatalyst for Efficient Electrochemical and Photo-Electrochemical Oxygen Evolution. Advanced Functional Materials. 2017 ;27.
Hackler A, Patrick SL, Kahney EW, Flaherty DP, Sharlow ER, Morris JC, Golden JE. Antiparasitic lethality of sulfonamidebenzamides in kinetoplastids. Bioorganic & Medicinal Chemistry Letters. 2017 ;27:755-758.
Laskar MR, Jackson DHK, Xu SZ, Hamers RJ, Morgan D, Kuech TF. Atomic Layer Deposited MgO: A Lower Overpotential Coating for Li Ni0.5Mn0.3Co0.2 O-2 Cathode. ACS Applied Materials & Interfaces. 2017 ;9:11231-11239.
Kearns NM, Mehlenbacher RD, Jones AC, Zanni MT. Broadband 2D electronic spectrometer using white light and pulse shaping: noise and signal evaluation at 1 and 100 kHz. Optics Express. 2017 ;25:7869-7883.
Xiao GZ, Cintron-Rosado GA, Glazier DA, Xi BM, Liu C, Liu P, Tang WP. Catalytic Site-Selective Acylation of Carbohydrates Directed by Cation-n Interaction. Journal of the American Chemical Society. 2017 ;139:4346-4349.
Goldsmith ZK, Harshan AK, Gerken JB, Voros M, Galli G, Stahl SS, Hammes-Schiffer S. Characterization of NiFe oxyhydroxide electrocatalysts by integrated electronic structure calculations and spectroelectrochemistry. Proceedings of the National Academy of Sciences of the United States of America. 2017 ;114:3050-3055.
Wang HY, Simmons CJ, Zhang Y, Smits AM, Balzer PG, Wang SJ, Tang WP. Chiral Catalyst-Directed Dynamic Kinetic Diastereoselective Acylation of Anomeric Hydroxyl Groups and a Controlled Reduction of the Glycosyl Ester Products. Organic Letters. 2017 ;19:508-511.
Qi YH, Pradipta AR, Li M, Zhao X, Lu LL, Fu XG, Wei J, Hsung RP, Tanaka K, Zhou LJ. Cinchonine induces apoptosis of HeLa and A549 cells through targeting TRAF6. Journal of Experimental and Clinical Cancer Research. 2017 ;36.
Palit S, He LL, Hamilton WA, Yethiraj A, Yethiraj A. Combining Diffusion NMR and Small-Angle Neutron Scattering Enables Precise Measurements of Polymer Chain Compression in a Crowded Environment. Physical Review Letters. 2017 ;118.
Shearer MJ, Samad L, Zhang Y, Zhao YZ, Puretzky A, Eliceir KW, Wright JC, Hamers RJ, Jin S. Complex and Noncentrosymmetric Stacking of Layered Metal Dichalcogenide Materials Created by Screw Dislocations. Journal of the American Chemical Society. 2017 ;139:3496-3504.
Hruszkewycz DP, Miles KC, Thiel OR, Stahl SS. Co/NHPI-mediated aerobic oxygenation of benzylic C-H bonds in pharmaceutically relevant molecules. Chemical Science. 2017 ;8:1282-1287.
Renner LD, Zan JD, Hu LI, Martinez M, Resto PJ, Siegel AC, Torres C, Hall SB, Slezak TR, Nguyen TH, et al. Detection of ESKAPE Bacterial Pathogens at the Point of Care Using Isothermal DNA-Based Assays in a Portable Degas-Actuated Microfluidic Diagnostic Assay Platform. Applied and Environmental Microbiology. 2017 ;83:13.
Jaworski JN, McCann SD, Guzei IA, Stahl SS. Detection of Palladium(I) in Aerobic Oxidation Catalysis. Angewandte Chemie-International Edition. 2017 ;56:3605-3610.
Golt F, Love AM, Hermans I. Developing a Thermodynamic Model for the Interactions between Water and Cu in the Zeolite SSZ-13. Journal of Physical Chemistry C. 2017 ;121:6160-6169.
Mannel DS, Ahmed MS, Root TW, Stahl SS. Discovery of Multicomponent Heterogeneous Catalysts via Admixture Screening: PdBiTe Catalysts for Aerobic Oxidative Esterification of Primary Alcohols. Journal of the American Chemical Society. 2017 ;139:1690-1698.
Huang CB, Powell CT, Sung Y, Cai T, Yu L. Effect of Low-Concentration Polymers on Crystal Growth in Molecular Glasses: A Controlling Role for Polymer Segmental Mobility Relative to Host Dynamics. Journal of Physical Chemistry B. 2017 ;121:1963-1971.
Mantha S, McDaniel JG, Perroni DV, Mahanthappa MK, Yethiraj A. Electrostatic Interactions Govern "Odd/Even" Effects in Water-Induced Gemini Surfactant Self-Assembly. Journal of Physical Chemistry B. 2017 ;121:565-576.
Jackson CM. Emil Fischer and the "art of chemical experimentation". Hist Sci. 2017 ;55:86-120.
Ostrander JS, Knepper R, Tappan AS, Kay JJ, Zanni MT, Farrow DA. Energy Transfer Between Coherently Delocalized States in Thin Films of the Explosive Pentaerythritol Tetranitrate (PETN) Revealed by Two-Dimensional Infrared Spectroscopy. Journal of Physical Chemistry B. 2017 ;121:1352-1361.
Gordhan HM, Patrick SL, Swasy MI, Hackler AL, Anayee M, Golden JE, Morris JC, Whitehead DC. Evaluation of substituted ebselen derivatives as potential trypanocidal agents. Bioorganic & Medicinal Chemistry Letters. 2017 ;27:537-541.
Shin JY, Shaloski MA, Crim FF, Case AS. First Evidence of Vibrationally Driven Bimolecular Reactions in Solution: Reactions of Br Atoms with Dimethylsulfoxide and Methanol. Journal of Physical Chemistry B. 2017 ;121:2486-2494.
Van Kan JAL, Stassen JHM, Mosbach A, Van der Lee TAJ, Faino L, Farmer AD, Papasotiriou DG, Zhou SG, Seidl MF, Cottam E, et al. A gapless genome sequence of the fungus Botrytis cinerea. Molecular Plant Pathology. 2017 ;18:75-89.
Manger LH, Rowley MB, Fu YP, Foote AK, Rea MT, Wood SL, Jin S, Wright JC, Goldsmith RH. Global Analysis of Perovskite Photophysics Reveals Importance of Geminate Pathways. Journal of Physical Chemistry C. 2017 ;121:1062-1071.
Qiu TA, Nguyen THT, Hudson-Smith NV, Clement PL, Forester DC, Frew H, Hang MN, Murphy CJ, Hamers RJ, Feng ZV, et al. Growth-Based Bacterial Viability Assay for Interference -Free and High-Throughput Toxicity Screening of Nanomaterials. Analytical Chemistry. 2017 ;89:2057-2064.
Yano Y, Kondo K, Watanabe Y, Zhang TQO, Ho JJ, Oishi S, Fujii N, Zanni MT, Matsuzaki K. GXXXG-Mediated Parallel and Antiparallel Dimerization of Transmembrane Helices and Its Inhibition by Cholesterol: Single-Pair FRET and 2D IR Studies. Angewandte Chemie-International Edition. 2017 ;56:1756-1759.
Gujral A, Gomez J, Jiang J, Huang CB, O'Hara KA, Toney MF, Chabinyc ML, Yu L, Ediger MD. Highly Organized Smectic-like Packing in Vapor-Deposited Glasses of a Liquid Crystal. Chemistry of Materials. 2017 ;29:849-858.
Hong JW, Hamers RJ, Pedersen JA, Cui Q. A Hybrid Molecular Dynamics/Multiconformer Continuum Electrostatics (MD/MCCE) Approach for the Determination of Surface Charge of Nanomaterials. Journal of Physical Chemistry C. 2017 ;121:3584-3596.
Yu Q, Shi XD, Feng Y, Kent KC, Li LJ. Improving data quality and preserving HCD-generated reporter ions with EThcD for isobaric tag-based quantitative proteomics and proteome-wide PTM studies. Analytica Chimica Acta. 2017 ;968:40-49.
Acheson JF, Bailey LJ, Brunold TC, Fox BG. In-crystal reaction cycle of a toluene-bound diiron hydroxylase. Nature. 2017 ;544:191-+.
Laventure A, Gujral A, Lebel O, Pellerin C, Ediger MD. Influence of Hydrogen Bonding on the Kinetic Stability of Vapor-Deposited Glasses of Triazine Derivatives. Journal of Physical Chemistry B. 2017 ;121:2350-2358.
Conrad S, Wolf P, Muller P, Orsted H, Hermans I. Influence of Hydrophilicity on the Sn beta-Catalyzed Baeyer-Villiger Oxidation of Cyclohexanone with Aqueous Hydrogen Peroxide. Chemcatchem. 2017 ;9:175-182.
Gunsolus IL, Hang MN, Hudson-Smith NV, Buchman JT, Bennett JW, Conroy D, Mason SE, Hamers RJ, Haynes CL. Influence of nickel manganese cobalt oxide nanoparticle composition on toxicity toward Shewanella oneidensis MR-1: redesigning for reduced biological impact. Environmental Science-Nano. 2017 ;4:636-646.
Checco JW, Gellman SH. Iterative Nonproteinogenic Residue Incorporation Yields alpha/beta-Peptides with a Helix-Loop-Helix Tertiary Structure and High Affinity for VEGF. Chembiochem. 2017 ;18:291-299.
Hao L, Johnson J, Lietz CB, Buchberger A, Frost D, Kao WJ, Li LJ. Mass Defect-Based N,N-Dimethyl Leucine Labels for Quantitative Proteomics and Amine Metabolomics of Pancreatic Cancer Cells. Analytical Chemistry. 2017 ;89:1138-1146.
Henderson KL, Felth LC, Molzahn CM, Shkel I, Wang S, Chhabra M, Ruff EF, Bieter L, Kraft JE, Record MT. Mechanism of transcription initiation and promoter escape by E. coli RNA polymerase. Proceedings of the National Academy of Sciences of the United States of America. 2017 ;114:E3032-E3040.
Govindaraju GV, Wheeler GP, Lee D, Choi KS. Methods for Electrochemical Synthesis and Photoelectrochemical Characterization for Photoelectrodes. Chemistry of Materials. 2017 ;29:355-370.
Zheng YQ, Cui Q. Microscopic mechanisms that govern the titration response and pK(a) values of buried residues in staphylococcal nuclease mutants. Proteins-Structure Function and Bioinformatics. 2017 ;85:268-281.
Walters NA, Amberger BK, Esselman B, Woods RC, McMahon RJ. Millimeter-wave spectroscopy of syn formyl azide (HC(O)N-3) in seven vibrational states. Journal of Molecular Spectroscopy. 2017 ;331:71-81.
Gilbert PUPA, Bergmann KD, Myers CE, Marcus MA, DeVol RT, Sun CY, Blonsky AZ, Tamre E, Zhao J, Karan EA, et al. Nacre tablet thickness records formation temperature in modern and fossil shells. Earth and Planetary Science Letters. 2017 ;460:281-292.
Carlson TM, Lam KW, Lam CW, He JZ, Maynard JH, Cavagnero S. Naked-Eye Detection of Reversible Protein Folding and Unfolding in Aqueous Solution. Journal of Chemical Education. 2017 ;94:350-355.
Hamers RJ. Nanomaterials and Global Sustainability. Accounts of Chemical Research. 2017 ;50:633-637.
Gomez J, Gujral A, Huang CB, Bishop C, Yu L, Ediger MD. Nematic-like stable glasses without equilibrium liquid crystal phases. Journal of Chemical Physics. 2017 ;146.
Chen GJ, Jaskula-Sztul R, Esquibel CR, Lou I, Zheng QF, Dammalapati A, Harrison A, Eliceiri KW, Tang WP, Chen H, et al. Neuroendocrine Tumor-Targeted Upconversion Nanoparticle-Based Micelles for Simultaneous NIR-Controlled Combination Chemotherapy and Photodynamic Therapy, and Fluorescence Imaging. Advanced Functional Materials. 2017 ;27.
Huihui KM, Shrestha R, Weix DJ. Nickel-Catalyzed Reductive Conjugate Addition of Primary Alkyl Bromides to Enones To Form Silyl Enol Ethers. Organic Letters. 2017 ;19:340-343.
Goldschen-Ohm MP, White DS, Klenchin VA, Chanda B, Goldsmith RH. Observing Single-Molecule Dynamics at Millimolar Concentrations. Angewandte Chemie-International Edition. 2017 ;59:2399-2402.
Zhu HM, Trinh MT, Wang J, Fu YP, Joshi PP, Miyata K, Jin S, Zhu XY. Organic Cations Might Not Be Essential to the Remarkable Properties of Band Edge Carriers in Lead Halide Perovskites. Advanced Materials. 2017 ;29.