Advertisement
Research Article

Structured Pathway across the Transition State for Peptide Folding Revealed by Molecular Dynamics Simulations

  • Lipi Thukral,

    Affiliation: Interdisciplinary Center for Scientific Computing, University of Heidelberg, Heidelberg, Germany

    X
  • Isabella Daidone mail,

    daidone@caspur.it (ID); smithjc@ornl.gov (JCS)

    Affiliation: Department of Chemistry, Chemical Engineering and Materials, University of L'Aquila, Coppito, Italy

    X
  • Jeremy C. Smith mail

    daidone@caspur.it (ID); smithjc@ornl.gov (JCS)

    Affiliation: UT/ORNL Center for Molecular Biophysics, Oak Ridge National Laboratory, Oak Ridge, Tennessee

    X
  • Published: September 08, 2011
  • DOI: 10.1371/journal.pcbi.1002137

About the Authors

Lipi Thukral
Interdisciplinary Center for Scientific Computing, University of Heidelberg, Heidelberg, Germany
Isabella Daidone
Department of Chemistry, Chemical Engineering and Materials, University of L'Aquila, Coppito, Italy
Jeremy C. Smith
UT/ORNL Center for Molecular Biophysics, Oak Ridge National Laboratory, Oak Ridge, Tennessee

Corresponding Authors

Competing Interests

The authors have declared that no competing interests exist.

Author Contributions

Conceived and designed the experiments: LT ID JCS. Performed the experiments: LT. Analyzed the data: LT. Wrote the paper: LT ID JCS.