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pro vyhledávání: '"Mai V. Zhou"'
Autor:
Taha Rezai, Jonathan E. Bock, Matthew P. Jacobson, Chakrapani Kalyanaraman, Mai V. Zhou, R. Scott Lokey
Publikováno v:
Journal of the American Chemical Society. 128:14073-14080
We report an atomistic physical model for the passive membrane permeability of cyclic peptides. The computational modeling was performed in advance of the experiments and did not involve the use of "training data". The model explicitly treats the con