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Research Article

Potent New Small-Molecule Inhibitor of Botulinum Neurotoxin Serotype A Endopeptidase Developed by Synthesis-Based Computer-Aided Molecular Design

  • Yuan-Ping Pang mail,

    pang@mayo.edu (YPP); james.schmidt@det.amedd.army.mil (JJS)

    Affiliation: Computer-Aided Molecular Design Laboratory, Mayo Clinic, Rochester, Minnesota, United States of America

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  • Anuradha Vummenthala,

    Affiliation: Computer-Aided Molecular Design Laboratory, Mayo Clinic, Rochester, Minnesota, United States of America

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  • Rajesh K. Mishra,

    Affiliation: Computer-Aided Molecular Design Laboratory, Mayo Clinic, Rochester, Minnesota, United States of America

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  • Jewn Giew Park,

    Affiliation: Computer-Aided Molecular Design Laboratory, Mayo Clinic, Rochester, Minnesota, United States of America

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  • Shaohua Wang,

    Affiliation: Computer-Aided Molecular Design Laboratory, Mayo Clinic, Rochester, Minnesota, United States of America

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  • Jon Davis,

    Affiliation: Division of Biochemistry, Walter Reed Army Institute of Research, Silver Spring, Maryland, United States of America

    Current address: Integrated Toxicology Division, United States Army Medical Research Institute of Infectious Diseases, Frederick, Maryland, United States of America

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  • Charles B. Millard,

    Affiliation: Division of Biochemistry, Walter Reed Army Institute of Research, Silver Spring, Maryland, United States of America

    Current address: United States Army Medical Research & Materiel Command, Fort Detrick, Maryland, United States of America

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  • James J. Schmidt mail

    pang@mayo.edu (YPP); james.schmidt@det.amedd.army.mil (JJS)

    Affiliation: Integrated Toxicology Division, United States Army Medical Research Institute of Infectious Diseases, Frederick, Maryland, United States of America

    X
  • Published: November 10, 2009
  • DOI: 10.1371/journal.pone.0007730

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