Chemistry Publications
Research in the Department of Chemistry covers a broad spectrum of chemical specialties but generally falls within three research themes: Materials and Biomaterials; Computational Sciences and Environmental Science and Ecology.
Visit the Department of Chemistry website for additional information.
Submissions from 2020
First Ionization Energy as the Asymptotic Limit of the Average Local Electron Energy, Amer M. El-Samman, Egor Ospadov, and Viktor N. Staroverov
Asymptotic behavior of the average local ionization energy in finite basis sets, Amer M. El-Samman and Viktor N. Staroverov
Reflections on the Evolution of Smart Polymers, Elizabeth R. Gillies
Phosphonium versus Ammonium Compact Polyelectrolyte Complex Networks with Alginate-Comparing Their Properties and Cargo Encapsulation., Tristan D. Harrison, Alexandre J. Salmon, John R. de Bruyn, Paul J. Ragogna, and Elizabeth R. Gillies
Deciphering tip-enhanced Raman imaging of carbon nanotubes with deep learning neural networks., Usant Kajendirarajah, María Olivia Avilés, and François Lagugné-Labarthet
Cationic Boron Formazanate Dyes, Benjamin D. Katzman, Paul D. Boyle, Viktor N. Staroverov, Joe Gilroy, and Ryan R. Maar
Identification of intermediate compounds and photodegradation mechanisms of omeprazole under the system UV/O2, Elisa Leyva, Edgar Moctezuma, Kim M. Baines, Saúl Noriega, Francisco Pérez Flores, and Carmen Lara-Pérez
Neutral, water-soluble poly(ester amide) hydrogels for cell encapsulation, Natalie Liang, Lauren E. Flynn, and Elizabeth R. Gillies
Chlorine-35 Solid-State Nuclear Magnetic Resonance Spectroscopy as an Indirect Probe of the Oxidation Number of Tin in Tin Chlorides, Bryan E.G. Lucier, Victor V. Terskikh, Jiacheng Guo, Jeremy L. Bourque, Sarah L. McOnie, John A. Ripmeester, Yining Huang, and Kim M. Baines
Enhancing Protein Electrospray Charge States by Multivalent Metal Ions: Mechanistic Insights from MD Simulations and Mass Spectrometry Experiments., Leanne M Martin and Lars Konermann
Thermoresponsive Self-Immolative Polyglyoxylamides., Amir Rabiee Kenaree, Quinton E. A. Sirianni, Kyle Classen, and Elizabeth R. Gillies
Gas Phase Protein Folding Triggered by Proton Stripping Generates Inside-Out Structures: A Molecular Dynamics Simulation Study., Alexander I M Sever and Lars Konermann
The architectural evolution of self-immolative polymers, Quinton E.A. Sirianni and Elizabeth R. Gillies
Analysis of Temperature-Dependent H/D Exchange Mass Spectrometry Experiments., Nastaran N Tajoddin and Lars Konermann
GSK3787-Loaded poly(Ester Amide) particles for intra-articular drug delivery, Ian J. Villamagna, Danielle M. McRae, Aneta Borecki, Xueli Mei, François Lagugné-Labarthet, Frank Beier, and Elizabeth Gillies
A Boron Difluoride Hydrazone (BODIHY) Polymer Exhibits Aggregation-Induced Emission, Alexander E. R. Watson, Joe Gilroy, and Daniela Cappello
Synthesis of Hexahydropyridazines by [4 + 2] Cycloaddition of Donor-Acceptor Cyclobutanes and, Jackie Wu, Paul Winiarz, Dhwanish Patel, Johanna de Jong, David Tong, Tristan Chidley, Naresh Vemula, and Brian L Pagenkopf
Benzosiloles with Crystallization-induced Emission Enhancement of Electrochemiluminescence: Synthesis, Electrochemistry, and Crystallography, Liuqing Yang, Donghyun Koo, Jackie Wu, Jonathan M. Wong, Tyler Day, Ruizhong Zhang, Harshana Kolongoda, Kehan Liu, Jian Wang, Zhifeng Ding, and Brian Pagenkopf
Transesterification of Poly(ethyl glyoxylate): A Route to Structurally Diverse Polyglyoxylates, Rebecca E. Yardley, Amir Rabiee Kenaree, Xiaoli Liang, and Elizabeth R. Gillies
Delineating Heme-Mediated versus Direct Protein Oxidation in Peroxidase-Activated Cytochrome, Victor Yin, Derek Holzscherer, and Lars Konermann
Submissions from 2019
Protein Ions Generated by Native Electrospray Ionization: Comparison of Gas Phase, Solution, and Crystal Structures., Maryam Bakhtiari and Lars Konermann
Carving Plasmon Modes in Silver Sierpiński Fractals, Isobel C. Bicket, Edson P. Bellido, Danielle M. McRae, Francois Lagugne-Labarthet, and Gianluigi A. Botton
Fabrication and In-Situ Cross-linking of Carboxylic Acid-Functionalized Poly(ester amide) Scaffolds for Tissue Engineering, Kai Cao, Derek S. Flegg, Shigang Lin, Francois Lagugne-Labarthet, Kibret Mequanint, and Elizabeth Gillies
Optoelectronic, Aggregation, and Redox Properties of Double-Rotor Boron Difluoride Hydrazone Dyes, Daniela Cappello, Denis A.B. Therien, Viktor N. Staroverov, Francois Lagugne-Labarthet, and Joe Gilroy
Altering the optoelectronic properties of boron difluoride formazanate dyes via conjugation with platinum(II)-acetylides, Jasveer S. Dhindsa, Adyn Melenbacher, Stephanie M. Barbon, Martin J. Stillman, and Joe Gilroy