Convergence and Sampling in Determining Free Energy Landscapes for Membrane Protein Association
Potential of mean force (PMF) calculations are used to characterize the free energy landscape of protein-lipid and protein-protein association within membranes. Coarse-grained simulations allow binding free energies to be determined with reasonable statistical error. This accuracy relies on defining...
| Main Authors: | , , , , |
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| Format: | Journal article |
| Published: |
American Chemical Society
2016
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