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Faculty - Noteworthy

PUBLICATIONS

[1]          A. Watson; S. Hackbusch; A. H. Franz, NMR solution geometry of saccharides containing the 6-O-(α-D-glucopyranosyl)-α/β-D-glucopyranose (isomaltose) or 6-O-(α-D-galactopyranosyl)-α/β-D-glucopyranose (melibiose) core. Carbohydr. Res. 473 (2019), 18-35.
[2]          S. Wang, et. al., Thiazole orange - Spermine conjugate: A potent human telomerase inhibitor comparable to BRACO-19. Eur. J. Med. Chem. 175 (2019), 20-33.
[3]          K. Voronova, et. al., Dissociative photoionization of chromium hexacarbonyl: A round-trip ticket to non-statisticality and a detective story in thermochemistry. Int. J. Mass Spectrom. 438 (2019), 63-71. [4]          M. Z. Uddin, et. al., Rational Design of Peptide Ligands Based on Knob-Socket Protein Packing Model Using CD13 as a Prototype Receptor. ACS Omega 4 (2019), 5126-5136.
[5]          K. G. Torma, et. al., Dissociative photoionization of the C7H8 isomers cycloheptatriene and toluene: looking at two sides of the same coin simultaneously. J. Phys. Chem. A 123 (2019), 3454-3463. [6]          S. Sachdeva, et. al., A Rational Approach for Creating Peptides Mimicking Antibody Binding. Sci. Rep. 9 (2019), 1-11.
[7]          S. Sachdeva, et. al., A Rational Approach for Creating Peptides Mimicking Antibody Binding. Sci Rep 9 (2019), 997.
[8]          Y. Liu; A. D. Dutoi, Excitonically renormalised coupled-cluster theory. Mol. Phys. 117 (2019), 446-461.
[9]          M. Fraund, et. al., Quantitative capabilities of STXM to measure spatially resolved organic volume fractions of mixed organic / inorganic particles. Atmos. Meas. Tech. 12 (2019), 1619-1633.
[10]        A. D. Dutoi; Y. Liu, Systematically improvable excitonic Hamiltonians for electronic structure theory. Mol. Phys. 117 (2019), 431-445.
[11]        P. Batoon, et. al., Characterization of protonated AcAlaDab and AcDabAla by IRMPD spectroscopy and molecular modeling. Int. J. Mass Spectrom. 444 (2019), 116178.
[12]        I. Antonov, et. al., To Boldly Look Where No One Has Looked Before: Identifying the Primary Photoproducts of Acetylacetone. J Phys Chem A 123 (2019), 5472-5490.
[13]        Y. Zheng, et. al., Fliposomes: trans-2-aminocyclohexanol-based amphiphiles as pH-sensitive conformational switches of liposome membrane - a structure-activity relationship study. Chem. Phys. Lipids 210 (2018), 129-141.
[14]        A. Watson; C. Wallis; A. H. Franz, NMR solution structures and MD-simulation of procyanidin B1, B2, and C1. ARKIVOC (Gainesville, FL, U. S.), 10.24820/ark.5550190.p010.340 (2018), 279-301.
[15]        S. Wang, et. al., Synthesis of nucleobase-neomycin conjugates and evaluation of their DNA binding, cytotoxicities, and antibacterial properties. Med. Chem. Res. 27 (2018), 1517-1527.
[16]        K. Voronova, et. al., Radical Thermometers, Thermochemistry, and Photoelectron Spectra: A Photoelectron Photoion Coincidence Spectroscopy Study of the Methyl Peroxy Radical. J. Phys. Chem. Lett. 9 (2018), 534-539.
[17]        M. F. Shaw, et. al., Photo-tautomerization of acetaldehyde as a photochemical source of formic acid in the troposphere. Nat Commun 9 (2018), 2584.
[18]        S. Hackbusch; A. Watson; A. H. Franz, Synthesis and conformational analysis of D-gluco-pyranosyl-(6,6')-D-gluco-pyranuronate, a model compound for the inter-glycan 6,6'-ester linkage. Carbohydr. Res. 458-459 (2018), 1-12.
[19]        K. J. Covert, et. al., Thermochemistry of the smallest QOOH radical from the roaming fragmentation of energy selected methyl hydroperoxide ions. Phys. Chem. Chem. Phys. 20 (2018), 21085-21094. [20]        P. Batoon, et. al., Conformations of Protonated AlaDap and DapAla Characterized by IRMPD Spectroscopy and Molecular Modeling. J. Phys. Chem. B 122 (2018), 2191-2202.


CONFERENCES (not comprehensive)

[1]          B. D. Gutierrez Cortes; A. D. Dutoi, Translationally transformed coupled-cluster (TT-CC) theory in a local basis for periodic systems. PHYS-0437.
[2]          E. Liu, et. al., Picoplatin derivatives for drug development: design, synthesis and characterization. NORM-74.
[3]          M. Ruyonga, et. al., Exploration of triazolyl-1,2-cyclohexane-hydroxy-dicarboxylic acids and triazolyl-cyclohexanols as potential regulators for glycosidases. CARB-46.
[4]          D. Shao, et. al., Picoplatin derivatives for drug development: DNA interaction, cell viability and cell accumulation study. NORM-194.
[5]          M. Singh, et. al., Use of neomycin as a side chain for phenanthroline based G-quadruplex binding ligands and telomerase inhibitors. MEDI-0129.
[6]          C. Van Beek; V. V. Samoshin, Exploration of cis-diamine-based conformationally locked chiral ligands in asymmetric synthesis. ORGN-0138.
[7]          L. Xue, Implementation of nucleic acid chemistry in undergraduate teaching and research. CHED-0162.