Performance Assessment of Semiempirical Molecular Orbital Methods in Describing Halogen Bonding: Quantum Mechanical and Quantum Mechanical/Molecular Mechanical-Molecular Dynamics Study

Published 2011 View Full Article

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Title
Performance Assessment of Semiempirical Molecular Orbital Methods in Describing Halogen Bonding: Quantum Mechanical and Quantum Mechanical/Molecular Mechanical-Molecular Dynamics Study
Authors
Keywords
-
Journal
Journal of Chemical Information and Modeling
Volume 51, Issue 10, Pages 2549-2559
Publisher
American Chemical Society (ACS)
Online
2011-09-27
DOI
10.1021/ci2002582

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