Recent advances in QM/MM free energy calculations using reference potentials

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Title
Recent advances in QM/MM free energy calculations using reference potentials
Authors
Keywords
Multiscale modeling, QM/MM free energy calculation, Averaging potential, Reference potential, Mean field approximation
Journal
BIOCHIMICA ET BIOPHYSICA ACTA-GENERAL SUBJECTS
Volume 1850, Issue 5, Pages 954-965
Publisher
Elsevier BV
Online
2014-07-17
DOI
10.1016/j.bbagen.2014.07.008

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