NDLI: Combined Metadynamics and Umbrella Sampling Method for the Calculation of Ion Permeation Free Energy Profiles

Content Provider	Scilit
Author	Zhang, Yong Voth, Gregory A.
Copyright Year	2011
Related Links	http://europepmc.org/articles/pmc4120845?pdf=render https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4120845/pdf
Ending Page	2283
Page Count	7
Starting Page	2277
ISSN	15499618
e-ISSN	15499626
DOI	10.1021/ct200100e
Journal	Journal of Chemical Theory and Computation
Issue Number	7
Volume Number	7
Language	English
Publisher	American Chemical Society (ACS)
Publisher Date	2011-07-12
Access Restriction	Open
Subject Keyword	Journal: Journal of Chemical Theory and Computation Atomic, Molecular and Chemical Physics Umbrella Sampling Energy Profiles Free Mean Force Combined Method Straight Line
Content Type	Text
Resource Type	Article
Subject	Physical and Theoretical Chemistry Computer Science Applications

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Combined Metadynamics and Umbrella Sampling Method for the Calculation of Ion Permeation Free Energy Profiles