X-Ray Crystallography Select Publications

2013
​Valasani, K.R., Chaney, M.O., Day, V.W., Shidu, Yan, S. (2013) Acetylcholinesterase Inhibitors: Structure Based Design, Synthesis, Pharmacophore Modeling and Virtual Screening. J. Chem. Inf. Model. 2013 Jun 18. [Epub ahead of print] PMID: 23777291

Miller, M.R., Zou, B., Shi, J., Flaherty, D.P., Simpson, D.S., Yao, T., Maki, B.E., Day, V.W., Douglas, J.T., Wu, M., McManus, O.B., Golden, J.E., Aubé, J., Li, M. (2012) Development of a Selective Chemical Inhibitor for the Two-Pore Potassium Channel, KCNK9. Probe Reports from the NIH Molecular Libraries Program [Internet]. Bethesda (MD): National Center for Biotechnology Information (US); 2010-2012 Apr 16 [updated 2013 Feb 28]. PMID: 23658958

Leto, D.F., Ingram, R., Day, V.W., Jackson, T.A. (2013) Spectroscopic properties and reactivity of a mononuclear oxomanganese(IV) complex. Chem Commun (Camb). 49(47):5378-80. PMID: 23657204

Painter, T.O., Bunn, J.R., Schoenen, F.J., Douglas, J.T., Day, V.W., Santini, C. (2013) Skeletal diversification via heteroatom linkage control: preparation of bicyclic and spirocyclic scaffolds from N-substituted homopropargyl alcohols. J. Org. Chem. 78(8):3720-30. PMID: 23510238

Zhang, H., Bazzill, J., Gallagher, R.J., Subramanian, C., Grogan, PT., Day, V.W., Kindscher, K., Cohen, M.S., Timmermann, B.N. (2013) Antiproliferative with anolides from Datura wrightii. J. Nat. Prod. 76(3):445-9. PMID: 23252848

Wang, Q.Q., Day, V.W., Bowman-James, K. (2013) Chemistry and structure of a host-guest relationship: the power of NMR and X-ray diffraction in tandem. J. Am. Chem. Soc. 135(1):392-9. PMID: 23194374

Moyer, B.A., Custelcean, R., Hay, B.P., Sessler, J.L., Bowman-James, K., Day, V.W., Kang, S.O. (2013) A case for molecular recognition in nuclear separations: sulfate separation from nuclear wastes. Inorg. Chem. 52(7):3473-90. PMID: 23134587

2012
​Frankowski, K., Patnaik, S., Schoenen, F., Huang, S., Norton, J., Wang, C., Titus, S., Ferrer, M., Zheng, W., Southall, N., Day, V.W., Aubé, J., Marugan, J.J. (2012) Discovery and Development of Small Molecules That Reduce PNC Prevalence. Probe Reports from the NIH Molecular Libraries Program [Internet]. Bethesda (MD): National Center for Biotechnology Information (US); 2010-. PMID: 23762948

Wang, Q.Q., Begum, R.A., Day, V.W., Bowman-James, K. (2012) Sulfur, oxygen, and nitrogen mustards: stability and reactivity. Org. Biomol. Chem. 10(44):8786-93. PMID: 23070251

Salunke, D.B., Yoo, E., Shukla, N.M., Balakrishna, R., Malladi, S.S., Serafin, K.J., Da,y V.W., Wang, X., David, S.A. (2012) Structure-activity relationships in human Toll-like receptor 8-active 2,3-diamino-furo[2,3-c]pyridines. J. Med. Chem. 55(18):8137-51. Epub 2012 Sep 7. PMID: 22924757

Marinaro, W.A., Schieber, L.J., Munson, E.J., Day, V.W., Stella, V.J. (2012) Properties of a model aryl boronic acid and its boroxine. J. Pharm. Sci. 101(9):3190-8. PMID: 22614918

Lovell, K.M., Vasiljevik, T., Araya, J.J., Lozama, A., Prevatt-Smith, K.M., Day, V.W., Dersch, C.M., Rothman, R.B., Butelman, E.R., Kreek, M.J., Prisinzano, T.E. (2012) Semisynthetic neoclerodanes as kappa opioid receptor probes. Bioorg. Med. Chem. 20(9):3100-10. PMID: 22464684

Hossain, M.A., Kang, S.O., Kut, J.A., Day, V.W., Bowman-James, K. (2012) Influence of charge on anion receptivity in amide-based macrocycles. Inorg. Chem. 51(8):4833-40. PMID: 22462618

Wang, Q.Q., Day, V.W., Bowman-James, K. (2012) Supramolecular encapsulation of tetrahedrally hydrated guests in a tetrahedron host. Angew Chem. Int. Ed. Engl. 51(9):2119-23. PMID: 22275143

2011
​Prevatt-Smith, K.M., Lovell, K.M., Simpson, D.S., Day, V.W., Douglas, J.T., Bosch, P., Dersch, C.M., Rothman, R.B., Kivell, B., Prisinzano, T.E. (2011) Potential Drug Abuse Therapeutics Derived from the Hallucinogenic Natural Product Salvinorin A. Medchemcomm. 2(12):1217-1222. PMID: 22442751

Kang, S.O., Lynch, V.M., Day, V.W., Anslyn, E.V. (2011) Enthalpy vs Entropy Driven Complexation of Homoallylic Alcohols by Rh(I) Complexes. Organometallics. 30(22):6233-6240. PMID: 22328800

Day, Timothy P.; Sil, Ditesh; Shukla, Nikunj M.; Anbanandam, Asokan; Day, Victor W.; David, Sunil A. (2011) Imbuing Aqueous Solubility to Amphotericin B and Nystatin with a Vitamin",, Molecular Pharmaceutics, 2011, 8, 297-301.

Yin, Guochuan; Danby, Andrew M.; Day, Victor W.; Roy, Suparna Baksi; Carter, John; Scheper, William M.; Busch, Daryle H. (2011) Similarities and Differences in Properties and Behavior of Two H2O2-Activated Manganese Catalysts having Structures Differing Only by Methyl and Ethyl Substituents. J. Coord. Chem. 64: 4-17.

2010
Kang, Sung Ok; Day, Victor W.; Bowman-James, Kristin, (2010) Fluoride: Solution- and Solid-State Structural Binding Probe”, Journal of Organic Chemistry, 2010, 75, 277-283.

Geiger, Robert A.; Cattoadhyay, Swarup; Day, Victor W.; Jackson, Timothy A.A (2010) Series of Peroxomanganese (III) Complexes Supported by Tetradentate Aminopyridyl Ligands: Detailed Spectroscopic and Computational Studies",, J. Am. Chem. Soc. 132: 2821-2831.

Stozak, Michal; Yao, Lei; Day, Victor W.; Powell, Douglas R.; Aubé, Jeffrey (2010) Structural Characterization of N-Protonated Amides: Regioselective N-Activation of Medium-Bridged Twisted Lactams", J. Am. Chem. Soc., 132: 8836-8837.

Chattopadhyay, Kalicharan; Jana, Ranjan; Day, Victor W.; Douglas, Justin T.; Tunge, Jon A. (2010) Mechanistic Origin of the Stereodivergence in Decarboxylative Allylation. Organic Letters 12: 3042-3045.

Mendy, John S.; Pilate, Marcy L.; Horne, Toyketa; Day, Victor W.; Hossain, Md. (2010) AlamgirEncapsulation and Selective Recognition of Sulfate Anion in an Azamacrocycle in Water. J. Chem. Soc. Chem. Comm. 46: 6084-6086.

Kang, Sung Ok; Day, Victor W.; Bowman-James, Kristin (2010) Tricyclic Host for Linear Anions. Inorg. Chem. 49: 8629-8636.

Kang, Sung-Ok; Llinares, Jose M.; Day, Victor W.; Bowman-James, Kristin (2010) Cryptand-like Anion Receptors. Chem. Soc. Reviews 39: 3980-4003.

Maher, Tiffany R.; Spaeth, Andrew D.; Neal, Brad M.; Berrie, Cindy; Thompson, Ward H.; Day, Victor W.; Barybin, Mikhail V. (2010) Linear 6,6'-Biazulenyl Framework Featuring Isocyanide Termini: Synthesis, Structure, Redox Behavior, Complexation and Self-Assembly on Au(111). J. Am. Chem. Soc. 132: 15924-15926.


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EVENTS
Ability to set up 24 NMR experiments at one time and eliminate periodic user intervention
Screen up to 100,000 compounds in two days for endpoint assays
Next-generation genome sequencing
Near-infrared and bioluminescence imaging instrumentation to track gene of interest and/or tumor growth
Expertise in the design and stability of various pharmaceutical dosage forms
More than 40 computational chemistry software programs and databases
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