Free Energies of Binding from Large-Scale First-Principles Quantum Mechanical Calculations: Application to Ligand Hydration Energies

Published 2013 View Full Article

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Title
Free Energies of Binding from Large-Scale First-Principles Quantum Mechanical Calculations: Application to Ligand Hydration Energies
Authors
Keywords
-
Journal
JOURNAL OF PHYSICAL CHEMISTRY B
Volume 117, Issue 32, Pages 9478-9485
Publisher
American Chemical Society (ACS)
Online
2013-07-10
DOI
10.1021/jp404518r

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