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Journal of Computational Chemistry|August 20, 2003
A comparison of the mechanism for the reductive half-reaction between pea seedling and other copper amine oxidases (CAOs)Rajeev Prabhakar, Per E M SiegbahnJournal of the American Chemical Society|March 25, 2004
A theoretical study of the mechanism for the biogenesis of cofactor topaquinone in copper amine oxidasesRajeev Prabhakar, Per E M SiegbahnThe Journal of Physical Chemistry. B|May 15, 2008
Comparative molecular dynamics studies of wild-type and oxidized forms of full-length Alzheimer amyloid beta-peptides Abeta(1-40) and Abeta(1-42)Luciano Triguero, Rajiv Singh, Rajeev PrabhakarJournal of Computational Chemistry|November 28, 2008
Insights into the mechanism of methionine oxidation catalyzed by metal (Cu(2+), Zn(2+), and Fe(3+)) - amyloid beta (Abeta) peptide complexes: A computational studyArghya Barman, Woody Taves, Rajeev PrabhakarJournal of Computational Chemistry|June 29, 2006
A DFT study of the mechanism of Ni superoxide dismutase (NiSOD): role of the active site cysteine-6 residue in the oxidative half-reactionRajeev Prabhakar, Keiji Morokuma, Djamaladdin G MusaevJournal of Computational Chemistry|February 3, 2005
A comparative study of various computational approaches in calculating the structure of pyridoxal 5'-phosphate (PLP)-dependent beta-lyase protein. The importance of protein environmentRajeev Prabhakar, Keiji Morokuma, Djamaladdin G MusaevMethods in Enzymology|May 30, 2024
Structural studies of catalytic peptides using molecular dynamics simulationsParth Rathee, Sreerag N Moorkkannur, Rajeev PrabhakarThe Journal of Physical Chemistry. B|May 4, 2018
Formation of Catalytically Active Binuclear Center of Glycerophosphodiesterase: A Molecular Dynamics StudyThomas J Paul, Gerhard Schenk, Rajeev PrabhakarBiochemistry|June 1, 2006
Peroxynitrite reductase activity of selenoprotein glutathione peroxidase: a computational studyRajeev Prabhakar, Keiji Morokuma, Djamaladdin G MusaevJournal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|December 25, 2009
Elucidation of insulin degrading enzyme catalyzed site specific hydrolytic cleavage of amyloid beta peptide: a comparative density functional theory studyRam Prasad Bora, Mehmet Ozbil, Rajeev PrabhakarPageof 9