Christopher T. Lee, Jeffrey Comer, Conner Herndon, Nelson Leung, Anna Pavlova, Robert V. Swift, Chris Tung, Christopher N. Rowley, Rommie E. Amaro, Christophe Chipot, Yi Wang, James C. Gumbart. Simulation-Based Approaches for Determining Membrane Permeability of Small Compounds. Journal of Chemical Information and Computer Sciences, 56(4):721-733, 2016. [doi]
Abstract is missing.