Use of Umbrella Sampling to Calculate the Entrance/Exit Pathway for Z-Pro-Prolinal Inhibitor in Prolyl Oligopeptidase

Published 2011 View Full Article

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Title
Use of Umbrella Sampling to Calculate the Entrance/Exit Pathway for Z-Pro-Prolinal Inhibitor in Prolyl Oligopeptidase
Authors
Keywords
-
Journal
Journal of Chemical Theory and Computation
Volume 7, Issue 6, Pages 1583-1594
Publisher
American Chemical Society (ACS)
Online
2011-04-30
DOI
10.1021/ct1007058

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