📣 Help Shape the Future of UKRI's Gateway to Research (GtR)

We're improving UKRI's Gateway to Research and are seeking your input! If you would be interested in being interviewed about the improvements we're making and to have your say about how we can make GtR more user-friendly, impactful, and effective for the Research and Innovation community, please email gateway@ukri.org.

Kinetic Isotope Effects from QM/MM Subset Hessians: "Cut-Off" Analysis for SN2 Methyl Transfer in Solution. (2012)

First Author: Williams IH

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