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Arvi Rauk

Affiliations: 
Chemistry University of Calgary, Calgary, Alberta, Canada 
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"Arvi Rauk"
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Parents

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Saul Wolfe grad student 1968 Queen's University, Canada

Children

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Tom Ziegler grad student 1972-1978 University of Calgary

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Publications

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Badran I, Rauk A, Shi Y. (2019) New Orbital Symmetry Allowed Route for Cycloreversion of Silacyclobutane and Its Methyl Derivatives. The Journal of Physical Chemistry. A
Opare SKA, Petoyan A, Mehrazma B, et al. (2015) Molecular dynamics study of the monomers and dimers of N -AcAβ(13-23)NH2: On the effect of pH on the aggregation of the amyloid beta peptide of Alzheimers disease Canadian Journal of Chemistry. 94: 273-281
Azimi S, Rauk A. (2013) Fe(III)-Heme Complexes with the Amyloid Beta Peptide of Alzheimer's Disease: QM/MM Investigations of Binding and Redox Properties of Heme Bound to the His Residues of Aβ(1-42). Journal of Chemical Theory and Computation. 9: 4233-42
Azimi S, Rauk A. (2012) The Binding of Fe(II)-Heme to the Amyloid Beta Peptide of Alzheimer's Disease: QM/MM Investigations. Journal of Chemical Theory and Computation. 8: 5150-8
Badran I, Rauk A, Shi YJ. (2012) Theoretical study on the ring-opening of 1,3-disilacyclobutane and H 2 elimination Journal of Physical Chemistry A. 116: 11806-11816
Alí-Torres J, Rodríguez-Santiago L, Sodupe M, et al. (2011) Structures and stabilities of Fe2+/3+ complexes relevant to Alzheimer's disease: an ab initio study. The Journal of Physical Chemistry. A. 115: 12523-30
Mothana B, Roy S, Rauk A. (2009) Molecular dynamics study of the interaction of Aβ(13-23) with β-sheet inhibitors Arkivoc. 2009: 116-134
Rickard GA, Bergès J, Houèe-Levin C, et al. (2008) Ab initio and QM/MM study of electron addition on the disulfide bond in thioredoxin. The Journal of Physical Chemistry. B. 112: 5774-87
Bergès J, Rickard GA, Rauk A, et al. (2008) Proton distribution in one-electron reduced thioredoxin modulated by aspartate 30: A QM/MM study Chemical Physics Letters. 454: 118-123
Armstrong DA, Waltz WL, Rauk A. (2006) Carbonate radical anion - Thermochemistry Canadian Journal of Chemistry. 84: 1614-1619
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