Search Results - "Calmiano, Mark"

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    Structure-based virtual screening for novel ligands by Pitt, William R, Calmiano, Mark D, Kroeplien, Boris, Taylor, Richard D, Turner, James P, King, Michael A

    “…Computational searches for novel ligands for a given protein binding site have become ubiquitous in the pharmaceutical industry, and are potentially equally…”
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    Journal Article
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    A white-knuckle ride of open COVID drug discovery by von Delft, Frank, Calmiano, Mark, Chodera, John, Griffen, Ed, Lee, Alpha, London, Nir, Matviuk, Tatiana, Perry, Ben, Robinson, Matt, von Delft, Annette

    Published in Nature (London) (17-06-2021)
    “…In early 2020, a spontaneous global collaboration came together to design a new, urgent antiviral treatment. There are lessons in what happened next. In early…”
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    Journal Article
  4. 4

    Natural Conformational Sampling of Human TNFα Visualized by Double Electron-Electron Resonance by Carrington, Bruce, Myers, William K., Horanyi, Peter, Calmiano, Mark, Lawson, Alastair D.G.

    Published in Biophysical journal (25-07-2017)
    “…Double electron-electron resonance in conjunction with site-directed spin labeling has been used to probe natural conformational sampling of the human tumor…”
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    Journal Article
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    Discovery of a novel series of quinoxalines as inhibitors of c-Met kinase by Porter, John, Lumb, Simon, Lecomte, Fabien, Reuberson, James, Foley, Anne, Calmiano, Mark, le Riche, Kelly, Edwards, Helen, Delgado, Jean, Franklin, Richard J., Gascon-Simorte, Jose M., Maloney, Alison, Meier, Christoph, Batchelor, Mark

    Published in Bioorganic & medicinal chemistry letters (15-01-2009)
    “…The SAR of a series of quinoxaline inhibitors of c-Met kinase is reported. A series of quinoxaline inhibitors of c-Met kinase is described. The postulated…”
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    Journal Article
  7. 7

    Computer simulation of molecular sorption in zeolites by Calmiano, Mark Daniel

    Published 01-01-2001
    “…The work presented in this thesis encompasses the computer simulation of molecular sorption. In Chapter 1 we outline the aims and objectives of this work…”
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    Dissertation