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List of works by Ian H Williams

A computational study of the influence of methyl substituents on competitive ring closure to α- and β-lactones.

scientific article published on 18 August 2017

A theoretical study of the force field for carbon trioxide

scientific article (publication date: May 1985)

Catalysis: transition-state molecular recognition? ⬇️

scientific article published on November 3, 2010

Computational Modeling of a Caged Methyl Cation: Structure, Energetics, and Vibrational Analysis

scientific article

Critical evaluation of anharmonicity and configurational averaging in QM/MM modelling of equilibrium isotope effects

scientific article published on 09 July 2020

Influence of Dielectric Environment upon Isotope Effects on Glycoside Heterolysis: Computational Evaluation and Atomic Hessian Analysis

scientific article published on 09 January 2020

Influence of Equatorial CH⋅⋅⋅O Interactions on Secondary Kinetic Isotope Effects for Methyl Transfer

scientific article published on 28 January 2016

Insights on the origin of catalysis on glycine N-methyltransferase from computational modelling.

scientific article published on 20 February 2018

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