Metastable States in the Hinge-Bending Landscape of an Enzyme in an Atomistic Cytoplasm Simulation

Author:

Samuel Russell Premila P.1ORCID,Maytin Andrew K.2ORCID,Rickard Meredith M.1ORCID,Russell Matthew C.3,Pogorelov Taras V.14567ORCID,Gruebele Martin1468ORCID

Affiliation:

1. Department of Chemistry, University of Illinois Urbana−Champaign, Urbana, Illinois 61801, United States

2. Department of Physics, University of Illinois Urbana−Champaign, Urbana, Illinois 61801, United States

3. Department of Mathematics, University of Illinois Urbana−Champaign, Urbana, Illinois 61801, United States

4. Center for Biophysics and Computational Biology, University of Illinois Urbana−Champaign, Urbana, Illinois 61801, United States

5. School of Chemical Sciences, University of Illinois Urbana−Champaign, Urbana, Illinois 61801, United States

6. Beckman Institute for Advanced Science and Technology, University of Illinois Urbana−Champaign, Urbana, Illinois 61801, United States

7. National Center for Supercomputing Applications, University of Illinois Urbana−Champaign, Urbana, Illinois 61801, United States

8. Carle-Illinois College of Medicine, University of Illinois Urbana−Champaign, Urbana, Illinois 61801, United States

Funder

Division of Molecular and Cellular Biosciences

University of Illinois at Urbana-Champaign

National Institute of General Medical Sciences

Publisher

American Chemical Society (ACS)

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