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Journal of the American Chemical Society|November 15, 2002
Electron density topological analysis of hydrogen bonding in glucopyranose and hydrated glucopyranoseRoger A KleinJournal of Computational Chemistry|May 22, 2003
Hydrogen bonding in diols and binary diol-water systems investigated using DFT methods. II. Calculated infrared OH-stretch frequencies, force constants, and NMR chemical shifts correlate with hydrogen bond geometry and electron density topology. A reevaluation of geometrical criteria for hydrogen bondingRoger A KleinJournal of Computational Chemistry|April 10, 2002
Ab initio conformational studies on diols and binary diol-water systems using DFT methods. Intramolecular hydrogen bonding and 1:1 complex formation with waterRoger A KleinAngewandte Chemie (International Ed. in English)|September 9, 2014
Anti-electrostatic hydrogen bondsFrank Weinhold, Roger A KleinOrganic & Biomolecular Chemistry|August 25, 2004
Barriers to internal rotation around the C-N bond in 3-(o-aryl)-5-methyl-rhodanines using NMR spectroscopy and computational studies. Electron density topological analysis of the transition statesYeliz Aydeniz, Funda Oguz, Arzu Yaman, et al.The Biochemical Journal|June 28, 2002
The functional consequences of mis-sense mutations affecting an intra-molecular salt bridge in arylsulphatase AFrank Schestag, Afshin Yaghootfam, Matthias Habetha, et al.JAMA Network Open|April 8, 2022
Effect of Plasma and Blood Donations on Levels of Perfluoroalkyl and Polyfluoroalkyl Substances in Firefighters in Australia: A Randomized Clinical TrialRobin Gasiorowski, Miriam K Forbes, Gabriel Silver, et al.Pageof 1