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Travis V. Harris, Ph.D. - Publications

Affiliations: 
2011 Chemistry and Biochemistry Montana State University, Bozeman, MT 
Area:
Inorganic Chemistry, Physical Chemistry, Biochemistry
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9 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2016 Harris TV, Szilagyi RK. Protein environmental effects on iron-sulfur clusters: A set of rules for constructing computational models for inner and outer coordination spheres. Journal of Computational Chemistry. PMID 27117497 DOI: 10.1002/Jcc.24384  0.648
2016 Honda K, Harris TV, Hatanaka M, Morokuma K, Mikami K. Computational SN2-type Mechanism for Difluoromethylation of Lithium Enolate with Fluoroform via Bimetallic C-F Bond Dual Activation. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 26992061 DOI: 10.1002/Chem.201601090  0.332
2014 Harris TV, Kurashige Y, Yanai T, Morokuma K. Ab initio density matrix renormalization group study of magnetic coupling in dinuclear iron and chromium complexes. The Journal of Chemical Physics. 140: 054303. PMID 24511936 DOI: 10.1063/1.4863345  0.409
2014 Harris TV, Szilagyi RK. Iron-sulfur bond covalency from electronic structure calculations for classical iron-sulfur clusters. Journal of Computational Chemistry. 35: 540-52. PMID 24458434 DOI: 10.1002/Jcc.23518  0.671
2013 Harris TV, Morokuma K. QM/MM structural and spectroscopic analysis of the di-iron(II) and di-iron(III) ferroxidase site in M ferritin. Inorganic Chemistry. 52: 8551-63. PMID 23865546 DOI: 10.1021/Ic4006168  0.496
2011 Harris TV, Szilagyi RK. Nitrogenase structure and function relationships by density functional theory. Methods in Molecular Biology (Clifton, N.J.). 766: 267-91. PMID 21833874 DOI: 10.1007/978-1-61779-194-9_18  0.635
2011 Harris TV, Szilagyi RK. Comparative assessment of the composition and charge state of nitrogenase FeMo-cofactor. Inorganic Chemistry. 50: 4811-24. PMID 21545160 DOI: 10.1021/Ic102446N  0.635
2009 Harris TV, Szilagyi RK, McFarlane Holman KL. Electronic structural investigations of ruthenium compounds and anticancer prodrugs. Journal of Biological Inorganic Chemistry : Jbic : a Publication of the Society of Biological Inorganic Chemistry. 14: 891-8. PMID 19350289 DOI: 10.1007/S00775-009-0501-0  0.622
2008 Pandey AS, Harris TV, Giles LJ, Peters JW, Szilagyi RK. Dithiomethylether as a ligand in the hydrogenase h-cluster. Journal of the American Chemical Society. 130: 4533-40. PMID 18324814 DOI: 10.1021/Ja711187E  0.579
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