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Research Article

Accessing a Hidden Conformation of the Maltose Binding Protein Using Accelerated Molecular Dynamics

  • Denis Bucher mail,

    bucher.denis@gmail.com

    Affiliation: Department of Chemistry and Biochemistry and Center for Theoretical Biological Physics, University of California at San Diego, La Jolla, California, United States of America

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  • Barry J. Grant,

    Affiliations: Department of Chemistry and Biochemistry and Center for Theoretical Biological Physics, University of California at San Diego, La Jolla, California, United States of America, Howard Hughes Medical Institute, University of California at San Diego, La Jolla, California, United States of America

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  • Phineus R. Markwick,

    Affiliations: Department of Chemistry and Biochemistry and Center for Theoretical Biological Physics, University of California at San Diego, La Jolla, California, United States of America, Howard Hughes Medical Institute, University of California at San Diego, La Jolla, California, United States of America

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  • J. Andrew McCammon

    Affiliations: Department of Chemistry and Biochemistry and Center for Theoretical Biological Physics, University of California at San Diego, La Jolla, California, United States of America, Howard Hughes Medical Institute, University of California at San Diego, La Jolla, California, United States of America, Department of Pharmacology, University of California at San Diego, La Jolla, California, United States of America

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  • Published: April 21, 2011
  • DOI: 10.1371/journal.pcbi.1002034

About the Authors

Denis Bucher, Barry J. Grant, Phineus R. Markwick, J. Andrew McCammon
Department of Chemistry and Biochemistry and Center for Theoretical Biological Physics, University of California at San Diego, La Jolla, California, United States of America
Barry J. Grant, Phineus R. Markwick, J. Andrew McCammon
Howard Hughes Medical Institute, University of California at San Diego, La Jolla, California, United States of America
J. Andrew McCammon
Department of Pharmacology, University of California at San Diego, La Jolla, California, United States of America

Corresponding Author

Email: bucher.denis@gmail.com

Competing Interests

The authors have declared that no competing interests exist.

Author Contributions

Conceived and designed the experiments: DB JAM. Performed the experiments: DB BJG PRM. Analyzed the data: DB BJG PRM. Contributed reagents/materials/analysis tools: DB BJG PRM JAM. Wrote the paper: DB BJG PRM JAM.