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Analytical Chemistry, ‎0003-2700

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  1. Exploiting the Propagation of Constrained Variables for Enhanced HDX-MS Data Optimization

    Salmas, R. E. & Borysik, A. J., 14 Dec 2021, In: Analytical Chemistry. 93, 49, p. 16417-16424 8 p.

    Research output: Contribution to journalArticlepeer-review

  2. High-Throughput Molecular Imaging via Deep-Learning-Enabled Raman Spectroscopy

    Horgan, C. C., Jensen, M., Nagelkerke, A., St-Pierre, J-P., Vercauteren, T., Stevens, M. M. & Bergholt, M. S., 7 Dec 2021, In: Analytical Chemistry. 93, 48, p. 15850-15860 11 p.

    Research output: Contribution to journalArticlepeer-review

  3. Inexpensive Portable Infrared Device to Detect and Quantify Alcohols in Hand Sanitizers for Public Health and Safety

    Ng, J. K., Tay, F. H., Wray, P. S., Mohd Saberi, S. S., Ting, K. K. K., Khor, S. M. & Chan, K. L. A., 3 Nov 2021, (E-pub ahead of print) In: Analytical Chemistry. 93, 45, p. 15015–15023

    Research output: Contribution to journalArticlepeer-review

  4. Characterization and Management of Noise in HDX-MS Data Modeling

    Salmas, R. E. & Borysik, A. J., 18 May 2021, In: Analytical Chemistry. 93, 19, p. 7323-7331 9 p.

    Research output: Contribution to journalArticlepeer-review

  5. Distribution and chemical speciation of exogenous micro- and nanoparticles in inflamed soft tissue adjacent to titanium and ceramic dental implants

    Nelson, K., Hesse, B., Addison, O., Morrell, A., Gross, C., Lagrange, A., Suarez, V., Kohal, R. & Fretwurst, T., 25 Sep 2020, (Accepted/In press) In: Analytical Chemistry.

    Research output: Contribution to journalArticlepeer-review

  6. Computational Strategies and Challenges for Using Native Ion Mobility Mass Spectrometry in Biophysics and Structural Biology

    Allison, T. M., Barran, P., Cianférani, S., Degiacomi, M. T., Gabelica, V., Grandori, R., Marklund, E. G., Menneteau, T., Migas, L. G., Politis, A., Sharon, M., Sobott, F., Thalassinos, K. & Benesch, J. L. P., 18 Aug 2020, In: Analytical Chemistry. 92, 16, p. 10872-10880 9 p.

    Research output: Contribution to journalReview articlepeer-review

  7. Software Requirements for the Analysis and Interpretation of Native Ion Mobility Mass Spectrometry Data

    Allison, T. M., Barran, P., Benesch, J. L. P., Cianferani, S., Degiacomi, M. T., Gabelica, V., Grandori, R., Marklund, E. G., Menneteau, T., Migas, L. G., Politis, A., Sharon, M., Sobott, F. & Thalassinos, K., 18 Aug 2020, In: Analytical Chemistry. 92, 16, p. 10881-10890 10 p.

    Research output: Contribution to journalReview articlepeer-review

  8. Detection of Microplastics in Ambient Particulate Matter Using Raman Spectral Imaging and Chemometric Analysis

    Levermore, J. M., Smith, T. E. L., Smith, T. E. L., Kelly, F. J. & Wright, S. L., 7 Jul 2020, In: Analytical Chemistry. 92, 13, p. 8732-8740 9 p.

    Research output: Contribution to journalArticlepeer-review

  9. Synchrotron Photothermal Infrared Nanospectroscopy of Drug-Induced Phospholipidosis in Macrophages

    Chan, K. L. A., Lekkas, I., Frogley, M., Cinque, G., Altharawi, A., Bello, G. & Dailey, L. A., 16 Jun 2020, In: Analytical Chemistry. 92, 12, p. 8097-8107 11 p.

    Research output: Contribution to journalArticlepeer-review

  10. Isothermal Titration Calorimetry Enables Rapid Characterization of Enzyme Kinetics and Inhibition for the Human Soluble Epoxide Hydrolase

    Abis, G., Pacheco-Gómez, R., Bui, T. T. T. & Conte, M. R., 3 Dec 2019, In: Analytical Chemistry. 91, 23, p. 14865-14872 8 p.

    Research output: Contribution to journalArticlepeer-review

  11. Protein-Lipid Interactions Stabilize the Oligomeric State of BOR1p from Saccharomyces cerevisiae

    Pyle, E., Guo, C., Hofmann, T., Schmidt, C., Ribiero, O., Politis, A. & Byrne, B., 1 Jan 2019, In: Analytical Chemistry.

    Research output: Contribution to journalArticlepeer-review

  12. Signature of Antibody Domain Exchange by Native Mass Spectrometry and Collision-Induced Unfolding

    Watanabe, Y., Vasiljevic, S., Allen, J. D., Seabright, G. E., Duyvesteyn, H. M. E., Doores, K. J., Crispin, M. & Struwe, W. B., 14 May 2018, (E-pub ahead of print) In: Analytical Chemistry.

    Research output: Contribution to journalArticlepeer-review

  13. Response to Comment on "Direct monitoring of exogenous GHB in body fluids by NMR spectroscopy": several issues to consider when quantifying GHB in biological matrices

    Palomino-Schätzlein, M., Brailsford, A. D., Parella, T. & Pérez-Trujillo, M., 30 Nov 2017, In: Analytical Chemistry.

    Research output: Contribution to journalArticlepeer-review

  14. Direct monitoring of Exogenous γ-Hydroxybutyric Acid in body fluids by NMR spectroscopy

    Palomino-Schätzlein, M., Wang, Y., Parella, T., Brailsford, A. D., Cowan, D. A., Legido-Quigley, C. & Pérez-Trujillo, M., 15 Aug 2017, In: Analytical Chemistry. 89, 16, p. 8343-8350 8 p.

    Research output: Contribution to journalArticlepeer-review

  15. Rapid analysis of anabolic steroid metabolites in urine by combining field asymmetric waveform ion mobility spectrometry with liquid chromatography and mass spectrometry

    Arthur, K. L., Turner, M. A., Brailsford, A. D., Kicman, A. T., Cowan, D. A., Reynolds, J. C. & Creaser, C. S., 18 Jul 2017, In: Analytical Chemistry. 89, 14, p. 7431-7437 7 p.

    Research output: Contribution to journalArticlepeer-review

  16. High-Speed Quantitative UPLC-MS Analysis of Multiple Amines in Human Plasma and Serum via Precolumn Derivatization with 6-Aminoquinolyl-N-hydroxysuccinimidyl Carbamate: Application to Acetaminophen-Induced Liver Failure

    Gray, N., Zia, R., King, A., Patel, V. C., Wendon, J., McPhail, M. J. W., Coen, M., Plumb, R. S., Wilson, I. D. & Nicholson, J. K., 21 Feb 2017, In: Analytical Chemistry. 89, 4, p. 2478-2487 10 p.

    Research output: Contribution to journalArticlepeer-review

  17. Surface Accessibility and Dynamics of Macromolecular Assemblies Probed by Covalent Labeling Mass Spectrometry and Integrative Modeling

    Schmidt, C., Macpherson, J. A., Lau, A. M., Tan, K. W., Fraternali, F. & Politis, A., 4 Jan 2017, (E-pub ahead of print) In: Analytical Chemistry. 89, 3, p. 1459–1468 10 p.

    Research output: Contribution to journalArticlepeer-review

  18. Monitoring Criminal Activity through Invisible Fluorescent “Peptide Coding” Taggants

    Gooch, J., Goh, H., Daniel, B. E., Abbate, V. & Frascione, N., 19 Apr 2016, In: Analytical Chemistry. 88, 8, p. 4169-4582

    Research output: Contribution to journalArticlepeer-review

  19. Elucidation of Drug Metabolite Structural Isomers Using Molecular Modeling Coupled with Ion Mobility Mass Spectrometry

    Reading, E., Munoz-Muriedas, J., Roberts, A. D., Dear, G. J., Robinson, C. V. & Beaumont, C., 16 Feb 2016, In: Analytical Chemistry. 88, 4, p. 2273-80 8 p.

    Research output: Contribution to journalArticlepeer-review

  20. LC-MS-Based Metabolomics Discovers Purine Endogenous Associations with Low-Dose Salbutamol in Urine Collected for Antidoping Tests

    Wang, Y., Caldwell, R., Cowan, D. A. & Legido-Quigley, C., 16 Feb 2016, In: Analytical Chemistry. 88, 4, p. 2243-2249 7 p.

    Research output: Contribution to journalArticlepeer-review

  21. Bile acid profiling and quantification in biofluids using ultra-performance liquid chromatography tandem mass spectrometry

    Sarafian, M. H., Lewis, M. R., Pechlivanis, A., Ralphs, S., McPhail, M. J. W., Patel, V. C., Dumas, M-E., Holmes, E. & Nicholson, J. K., 6 Oct 2015, In: Analytical Chemistry. 87, 19, p. 9662- 9670 9 p.

    Research output: Contribution to journalArticlepeer-review

  22. Structure and Dynamics of a Protein-Surfactant Assembly Studied by Ion-Mobility Mass Spectrometry and Molecular Dynamics Simulations

    Borysik, A. J., 1 Sep 2015, In: Analytical Chemistry. 87, 17, p. 8970-8976 7 p.

    Research output: Contribution to journalArticlepeer-review

  23. Batch-Specific Discrimination Using Nuclear Quadrupole Resonance Spectroscopy

    Kyriakidou, G., Jakobsson, A., Althoefer, K. & Barras, J., 7 Apr 2015, In: Analytical Chemistry. 87, 7, p. 3806-3811 6 p.

    Research output: Contribution to journalArticlepeer-review

  24. Insights into the Conformations of Three Structurally Diverse Proteins: Cytochrome c, p53, and MDM2, Provided by Variable-Temperature Ion Mobility Mass Spectrometry

    Dickinson, E. R., Jurneczko, E., Pacholarz, K. J., Clarke, D. J., Reeves, M., Ball, K. L., Hupp, T., Campopiano, D., Nikolova, P. V. & Barran, P. E., 17 Mar 2015, In: Analytical Chemistry. 87, 6, p. 3231-3238 8 p.

    Research output: Contribution to journalArticlepeer-review

  25. Characterizing variability of in vivo Raman spectroscopic properties of different anatomical sites of normal colorectal tissue towards cancer diagnosis at colonoscopy

    Bergholt, M. S., Zheng, W., Lin, K., Wang, J., Xu, H., Ho, K. Y., Teh, M., Yeoh, K. G. & Huang, Z., 20 Jan 2015, In: Analytical Chemistry. 87, 2, p. 960-6 7 p.

    Research output: Contribution to journalArticlepeer-review

  26. Label-Free in Situ Quantification of Drug in Living Cells at Micromolar Levels Using Infrared Spectroscopy

    Chan, K. L. A. & Vieira Fale, P. L., 2 Dec 2014, In: Analytical Chemistry. 86, 23, p. 11673-11679 7 p.

    Research output: Contribution to journalArticlepeer-review

  27. Creation of libraries of recurring mass spectra from large data sets assisted by a dual-column workflow

    Mallard, W. G., Andriamaharavo, N. R., Mirokhin, Y. A., Halket, J. M. & Stein, S. E., 21 Oct 2014, In: Analytical Chemistry. 86, 20, p. 10231-10238 8 p.

    Research output: Contribution to journalArticlepeer-review

  28. Development of a novel headspace sorptive extraction method to study the aging of volatile compounds in spent handgun cartridges

    Gallidabino, M., Romolo, F. S., Bylenga, K. & Weyermann, C., 6 May 2014, In: Analytical Chemistry. 86, 9, p. 4471-4478 8 p.

    Research output: Contribution to journalArticlepeer-review

  29. Prediction of chromatographic retention time in high-resolution anti-doping screening data using artificial neural networks

    Miller, T. H., Musenga, A., Cowan, D. A. & Barron, L. P., 5 Nov 2013, In: Analytical Chemistry. 85, 21, p. 10330-10337 8 p., N/A.

    Research output: Contribution to journalArticlepeer-review

  30. Metabolic Phenotype of the Healthy Rodent Model Using In-Vial Extraction of Dried Serum, Urine, and Cerebrospinal Fluid Spots

    Sen, A., Wang, Y., Chiu, K., Whiley, L., Cowan, D., Cheun-Chung Chang, R. & Legido Quigley, C., 6 Aug 2013, In: Analytical Chemistry. 85, 15, p. 7257–7263 7 p., N/A.

    Research output: Contribution to journalArticlepeer-review

  31. Infrared spectroscopy with heated attenuated total internal reflectance enabling precise measurement of thermally induced transitions in complex biological polymers

    Warren, F. J., Perston, B. B., Royall, P. G., Butterworth, P. J. & Ellis, P. R., 16 Apr 2013, In: Analytical Chemistry. 85, 8, p. 3999-4006 8 p.

    Research output: Contribution to journalArticlepeer-review

  32. Correcting the Effect of Refraction and Dispersion of Light in FT-IR Spectroscopic Imaging in Transmission through Thick Infrared Windows

    Chan, K. L. A. & Kazarian, S. G., 15 Jan 2013, In: Analytical Chemistry. 85, 2, p. 1029-1036 8 p., N/A.

    Research output: Contribution to journalArticlepeer-review

  33. Variable-Pitch Rectangular Cross-section Radiofrequency Coils for the Nitrogen-14 Nuclear Quadrupole Resonance Investigation of Sealed Medicines Packets

    Barras, J., Katsura, S., Sato-Akaba, H., Itozaki, H., Kyriakidou, G., Rowe, M. D., Althoefer, K. A. & Smith, J. A. S., 6 Nov 2012, In: Analytical Chemistry. 84, 21, p. 8970-8972 3 p., N/A.

    Research output: Contribution to journalArticlepeer-review

  34. In-Vial Dual Extraction for Direct LC-MS Analysis of Plasma for Comprehensive and Highly Reproducible Metabolic Fingerprinting

    Whiley, L., Godzien, J., Ruperez, F. J., Legido Quigley, C. & Barbas, C., 17 Jul 2012, In: Analytical Chemistry. 84, 14, p. 5992-5999 8 p.

    Research output: Contribution to journalArticlepeer-review

  35. FT-IR Spectroscopic Imaging of Reactions in Multiphase Flow in Microfluidic Channels

    Chan, A. & Kazarian, S. G., Apr 2012, In: Analytical Chemistry. 84, 9, p. 4052-6 5 p.

    Research output: Contribution to journalArticlepeer-review

  36. Generation of Chemical Movies: FT-IR Spectroscopic Imaging of Segmented Flows

    Chan, A., Niu, X. Z., DeMello, A. J. & Kazarian, S. G., 2011, In: Analytical Chemistry. 83, 9, p. 3606-9 4 p.

    Research output: Contribution to journalArticlepeer-review

  37. Multiplexed Detection of Metabolites of Narcotic Drugs from a Single Latent Fingermark

    Hazarika, P., Jickells, S. M., Wolff, K. & Russell, D. A., 15 Nov 2010, In: Analytical Chemistry. 82, 22, p. 9150 - 9154 5 p.

    Research output: Contribution to journalLetterpeer-review

  38. Toward Membrane-Free Amperometric Gas Sensors: A Microelectrode Array Approach

    Huang, X-J., Aldous, L., O'Mahony, A. M., Javier del Campo, F. & Compton, R. G., 15 Jun 2010, In: Analytical Chemistry. 82, 12, p. 5238-5245

    Research output: Contribution to journalArticlepeer-review

  39. Quantitative determination of acetylcholine and choline in microdialysis samples by MALDI-TOF MS

    Persike, M., Zimmermann, M., Klein, J. & Karas, M., 1 Feb 2010, In: Analytical Chemistry. 82, 3, p. 922-9 8 p.

    Research output: Contribution to journalArticlepeer-review

  40. Bidirectional Correlation of NMR and Capillary Electrophoresis Fingerprints: A New Approach to Investigating Schistosoma mansoni Infection in a Mouse Model

    Garcia-Perez, I., Alves, A. C., Angulo, S., Li, J. V., Utzinger, J., Ebbels, T. M. D., Legido-Quigley, C., Nicholson, J. K., Holmes, E. & Barbas, C., 2010, In: Analytical Chemistry. 82, 1, p. 203 - 210 8 p.

    Research output: Contribution to journalArticlepeer-review

  41. Quantitative Cl-35 Nuclear Quadrupole Resonance in Tablets of the Antidiabetic Medicine Diabinese

    Tate, E., Althoefer, K., Barras, J., Rowe, M. D., Smith, J. A. S., Pearce, G. E. S. & Wren, S. A. C., 1 Jul 2009, In: Analytical Chemistry. 81, 13, p. 5574 - 5576 3 p.

    Research output: Contribution to journalArticlepeer-review

  42. Attenuated total reflection-FT-IR spectroscopic imaging of protein crystallization

    Chan, A., Govada, L., Bill, R. M., Chayen, N. E. & Kazarian, S. G., 15 May 2009, In: Analytical Chemistry. 81, 10, p. 3769-3775 7 p.

    Research output: Contribution to journalArticlepeer-review

  43. Evaluation of a Microfluidic Device for the Electrochemical Determination of Halide Content in Ionic Liquids

    Ge, R., Allen, R. W. K., Aldous, L., Bown, M. R., Doy, N., Hardacre, C., MacInnes, J. M., McHale, G. & Newton, M. I., 15 Feb 2009, In: Analytical Chemistry. 81, 4, p. 1628-1637

    Research output: Contribution to journalArticlepeer-review

  44. Electrochemical Immunosensor for Detection of Celiac Disease Toxic Gliadin in Foodstuff

    Nassef, H. M., Redondo, M. C. B., Ciclitira, P. J., Ellis, H. J., Fragoso, A. & O'Sullivan, C. K., 1 Dec 2008, In: Analytical Chemistry. 80, 23, p. 9265 - 9271 7 p.

    Research output: Contribution to journalArticlepeer-review

  45. Identification of oxidation products of squalene in solution and in latent fingerprints by ESI/MS and LC-APCI/MS

    Mountfort, K., Bronstein, H., Archer, N. & Jickells, S., 1 Apr 2007, In: Analytical Chemistry. 79, 7, p. 2650 - 2657 8 p.

    Research output: Contribution to journalArticlepeer-review

  46. Hydrophilic Interaction Chromatography Using Methacrylate-Based Monolithic Capillary Column for the Separation of Polar Analytes

    Jiang, Z., Smith, N., Ferguson, P. & Taylor, M., 1 Feb 2007, In: Analytical Chemistry. 79, 3, p. 1243 - 1250 8 p.

    Research output: Contribution to journalArticlepeer-review

  47. Conductance maps by electrochemical tunneling spectroscopy to fingerprint the electrode electronic structure

    Diez-Perez, I., Guell, A. G., Sanz, F. & Gorostiza, P., 15 Oct 2006, In: Analytical Chemistry. 78, 20, p. 7325-7329

    Research output: Contribution to journalArticlepeer-review

  48. Identification and quantification of neuropeptides in brain tissue by capillary liquid chromatography coupled off-line to MALDI-TOF and MALDI-TOF/TOF-MS

    Wei, H., Nolkrantz, K., Chisolm, CN., Parkin, MC., O’Callaghan, JP. & Kennedy, RT., 1 Jul 2006, In: Analytical Chemistry. 78, 13, p. 4342 - 4351 10 p.

    Research output: Contribution to journalArticlepeer-review

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