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David Shemin grad student 1978 Northwestern
 (The roles of quaternary structure and of metal ions in the mechanism of action of porphobilinogen synthase.)


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Jory Z. Ruscio grad student 2007 Virginia Tech (Computer Science Tree)
Justin Alan Lemkul grad student 2007-2012 Virginia Tech
Stephanie N. Lewis grad student 2013 Virginia Tech
Anne M Brown grad student 2016 Virginia Tech
BETA: Related publications


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Pashikanti S, Foster DJ, Kharel Y, et al. (2022) Sphingosine Kinase 2 Inhibitors: Rigid Aliphatic Tail Derivatives Deliver Potent and Selective Analogues. Acs Bio & Med Chem Au. 2: 469-489
King KM, Bevan DR, Brown AM. (2022) Molecular Dynamics Simulations Indicate Aromaticity as a Key Factor in the Inhibition of IAPP Aggregation. Acs Chemical Neuroscience. 13: 1615-1626
Kawecki GE, King KM, Cramer NA, et al. (2022) Simulations of cross-amyloid aggregation of amyloid-β and islet amyloid polypeptide fragments. Biophysical Journal
Sharp AK, Newman D, Libonate G, et al. (2022) Biophysical insights into OR2T7: Investigation of a potential prognostic marker for glioblastoma. Biophysical Journal
Wu L, Velander P, Brown AM, et al. (2021) Rosmarinic Acid Potently Detoxifies Amylin Amyloid and Ameliorates Diabetic Pathology in a Transgenic Rat Model of Type 2 Diabetes. Acs Pharmacology & Translational Science. 4: 1322-1337
Congdon M, Fritzemeier RG, Kharel Y, et al. (2020) Probing the substitution pattern of indole-based scaffold reveals potent and selective sphingosine kinase 2 inhibitors. European Journal of Medicinal Chemistry. 212: 113121
Li H, Sibley CD, Kharel Y, et al. (2020) Lipophilic tail modifications of 2-(hydroxymethyl)pyrrolidine scaffold reveal dual sphingosine kinase 1 and 2 inhibitors. Bioorganic & Medicinal Chemistry. 30: 115941
Sibley CD, Morris EA, Kharel Y, et al. (2020) Discovery of a Small Side Cavity in Sphingosine Kinase 2 that Enhances Inhibitor Potency and Selectivity. Journal of Medicinal Chemistry
Hilu KW, Friend SA, Vallanadu V, et al. (2019) Molecular evolution of genes encoding allergen proteins in the peanuts genus Arachis: Structural and functional implications. Plos One. 14: e0222440
Worrell BL, Brown AM, Santos WL, et al. (2019) In silico Characterization of Structural Distinctions Between Isoforms of Human and Mouse Sphingosine Kinases for Accelerating Drug Discovery. Journal of Chemical Information and Modeling
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