John A. Barnes

Ring currents, local anisotropy, and the problem of the out-of-plane protons: a reinvestigation of the nuclear magnetic resonance spectrum of [10]-paracyclophane

Arvind Agarwal, John A. Barnes, John L. Fletcher et al. · Canadian Journal of Chemistry · 1977 · 50 citations

Engineering, Nuclear Physics, Proton-coupled Electron Transfer +18

Molecular orbital investigation of the structure of some polyatomic cations and anions of the main-group elements

Robert C. Burns, R. J. Gillespie, John A. Barnes et al. · Inorganic Chemistry · 1982 · 29 citations

Materials Science, Inorganic Chemistry, Engineering +15

Theoretical modelling of kinetic isotope effects for glycoside hydrolysis in aqueous solution by a hybrid quantum-mechanical/molecular-mechanical method

John A. Barnes, Ian H. Williams · Chemical Communications · 1996 · 24 citations

Chemical Kinetics, Computational Chemistry, Chemistry +19

Quantum mechanical/molecular mechanical approaches to transition state structure: Mechanism of sialidase action

John A. Barnes, Ian H. Williams · Biochemical Society Transactions · 1996 · 24 citations

Engineering, Molecular Biology, Computational Chemistry +21

Transition-state structural variation and mechanistic change

John A. Barnes, John Wilkie, Ian H. Williams · Journal of the Chemical Society Faraday Transactions · 1994 · 22 citations

Engineering, Chemical Transformation, Organic Chemistry +18