Boomsma, W., Tian, P., Frellsen, J., Ferkinghoff-Borg, J., Hamelryck, T., Lindorff-Larsen, K., Vendruscolo, M....
Date: 2014-09-23
Methods of protein structure determination based on NMR chemical shifts are becoming increasingly common. The most widely used approaches adopt the molecular fragment replacement strategy, in which structural fragments are repeatedly reassembled into different complete conformations in molecular simulations. Although these approaches are effective in generating individual structures consistent with... Read More
PNAS:
Number: 38
Volume: 111
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[NMR paper] Equilibrium simulations of proteins using molecular fragment replacement and NMR chemical shifts.
Equilibrium simulations of proteins using molecular fragment replacement and NMR chemical shifts.
Related Articles Equilibrium simulations of proteins using molecular fragment replacement and NMR chemical shifts.
Proc Natl Acad Sci U S A. 2014 Sep 5;
Authors: Boomsma W, Tian P, Frellsen J, Ferkinghoff-Borg J, Hamelryck T, Lindorff-Larsen K, Vendruscolo M
Abstract
Methods of protein structure determination based on NMR chemical shifts are becoming increasingly common. The most widely used approaches adopt the molecular...
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Equilibrium simulations with NMR chemical shifts [Biophysics and Computational Biology]
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