Stephen C. Rogers

QUASI: A general purpose implementation of the QM/MM approach and its application to problems in catalysis

Paul Sherwood, Alex H. de Vries, Martyn F. Guest et al. · Journal of Molecular Structure THEOCHEM · 2003 · 1K citations

Chemical Engineering, Engineering, Industrial Catalysis +12

Red Blood Cell and Endothelial eNOS Independently Regulate Circulating Nitric Oxide Metabolites and Blood Pressure

Francesca De Leo, Tatsiana Suvorava, Sophia K. Heuser et al. · Circulation · 2021 · 188 citations · Full text

Spectroscopic investigations of hydrogen bonding interactions in the gas phase. I. The determination of the geometry, dissociation energy, potential constants and electric dipole moment of the hydrogen-bonded heterodimer HCN • • • HF from its microwave rotational spectrum

A. C. Legon, D. J. Millen, Stephen C. Rogers · Proceedings of the Royal Society of London A Mathematical and Physical Sciences · 1980 · 181 citations

Computational evidence for anomalous diffusion of small molecules in amorphous polymers

Florian Müller‐Plathe, Stephen C. Rogers, Wilfred F. van Gunsteren · Chemical Physics Letters · 1992 · 159 citations

Engineering, Physics, Natural Sciences +9

Hypoxia modulates the purine salvage pathway and decreases red blood cell and supernatant levels of hypoxanthine during refrigerated storage

Travis Nemkov, Kaiqi Sun, Julie A. Reisz et al. · Haematologica · 2017 · 157 citations · Full text