Absolute Single-Molecule Entropies from Quasi-Harmonic Analysis of Microsecond Molecular Dynamics: Correction Terms and Convergence Properties

Published 2009 View Full Article

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Title
Absolute Single-Molecule Entropies from Quasi-Harmonic Analysis of Microsecond Molecular Dynamics: Correction Terms and Convergence Properties
Authors
Keywords
-
Journal
Journal of Chemical Theory and Computation
Volume 5, Issue 12, Pages 3150-3160
Publisher
American Chemical Society (ACS)
Online
2009-11-03
DOI
10.1021/ct900373z

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