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  1. No Access

    Article

    NMR-assisted computational studies of peptidomimetic inhibitors bound in the hydrophobic pocket of HIV-1 glycoprotein 41

    Due to the inherently flexible nature of a protein–protein interaction surface, it is difficult both to inhibit the association with a small molecule, and to predict how it might bind to the surface. In this s...

    Miriam Gochin, Landon R. Whitby… in Journal of Computer-Aided Molecular Design (2013)

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    Article

    Nuclear Magnetic Resonance Characterization of a Paramagnetic DNA-drug Complex with High Spin Cobalt; Assignment of the 1H and 31P NMR Spectra, and Determination of Electronic, Spectroscopic and Molecular Properties

    The proton NMR spectrum of the ternary complex between the octamer duplex d(TTGGCCAA)2, two molecules of the drug chromomycin-A3, and a divalent cobalt ion has been assigned. Assignment procedures used standar...

    Miriam Gochin in Journal of Biomolecular NMR (1998)

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    Chapter

    Refinement of Three-Dimensional Protein and DNA Structures in Solution from NMR Data

    Two-dimensional NMR, in particular two-dimensional nuclear Overhauser effect (2D NOE) spectra, when used in conjunction with distance geometry and energy refinement calculations can be used to determine the hi...

    Thomas L. James, Miriam Gochin… in Computational Aspects of the Study of Biol… (1991)