Kinetic Isotope Effects from QM/MM Subset Hessians: "Cut-Off" Analysis for SN2 Methyl Transfer in Solution. (2012)
Attributed to:
A computational framework for interpretation of kinetic isotope effects for organic reactions in solution
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1021/ct200771t
PubMed Identifier: 26596603
Publication URI: http://europepmc.org/abstract/MED/26596603
Type: Journal Article/Review
Volume: 8
Parent Publication: Journal of chemical theory and computation
Issue: 2
ISSN: 1549-9618