Correction to “Experimental Verification of Force Fields for Molecular

Jul 2, 2012 - Department of Chemistry, University College London, 20 Gordon Street, London WC1H 0AJ, United Kingdom. J. Phys. Chem. B , 2012, 116 ...
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Correction to “Experimental Verification of Force Fields for Molecular Dynamics Simulations Using Gly-Pro-Gly-Gly” Abil E. Aliev* and Denis Courtier-Murias Department of Chemistry, University College London, 20 Gordon Street, London WC1H 0AJ, United Kingdom

J. Phys. Chem. B 2010, 114, 12358−12375 S Supporting Information *

The Supporting Information for this manuscript has been corrected.



ASSOCIATED CONTENT

S Supporting Information *

Further results of NMR measurements (tables of chemical shifts and 3J-couplings), MD simulations (predicted population distribution graphs, free energy maps, and Ramachandran population maps; tables of chemical shifts, 3J-couplings, mean atomic distances, and predicted populations and φ/ψ positions), and QM calculations of vicinal J-couplings (Karplus curves). This material is available free of charge via the Internet at http://pubs.acs.org.

Published: July 2, 2012 © 2012 American Chemical Society

7996

dx.doi.org/10.1021/jp305793j | J. Phys. Chem. B 2012, 116, 7996−7996