Sason S. Shaik

Chemistry Hebrew University, Jerusalem, Jerusalem, Israel 
quantum chemistry
"Sason S. Shaik"

Mean distance: 7.4


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Nicholas D. Epiotis grad student 1974-1978 University of Washington
 (Spin Inversion in Triplet Reactions)
Roald Hoffmann post-doc 1978-1979 Cornell


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Sebastian Kozuch grad student Hebrew University
Avital Shruki grad student 1994-2000 Hebrew University
Elina Ploshnick grad student 2001-2006 Hebrew University
Shimirit Cohen grad student 2002-2007 Hebrew University
Dan Fishelovitch grad student 2005-2008 Hebrew University
Rinat Meir grad student 2007-2009 Hebrew University
Patric Schyman post-doc
Binju Wang post-doc 2012- Hebrew University
Rajeev R post-doc 2013- Hebrew University
Kshatresh Dutta Dubey post-doc 2014- Hebrew University
Dibyendu Mallick post-doc 2014- Hebrew University
A. Chandrasekhar Reddy post-doc 1992-1995 Hebrew University
G. Narahari Sastry post-doc 1994-1996 Hebrew University
Han Zuilhof post-doc 1994-1996 Rochester
John Morrison Galbraith post-doc 1997-1999 Hebrew University
Wei Wu post-doc 1997-1999 Hebrew University
Michael Filatov post-doc 1997-2000 Hebrew University
Francios Ogliaro post-doc 1999-2002 Hebrew University
Pankaz K. Sharma post-doc 2001-2003 Hebrew University
Sam P. de Visser post-doc 1999-2004 Hebrew University
Etienne Derat post-doc 2004-2006 Hebrew University
Carina Hazan post-doc 2003-2008 Hebrew University
Hirao Hajime post-doc 2005-2008 Hebrew University
Yong Wang post-doc 2007-2009 Hebrew University
Hui Chen post-doc 2006-2011 Hebrew University
Wenzhen Lai post-doc 2008-2011 Renmin University of China
Deepa Janardanan post-doc 2009-2012 Hebrew University
Mukesh Chourasia post-doc 2010-2012 Hebrew University
Chunsen Li post-doc 2010-2013 Hebrew University
Soumen Saha post-doc 2012-2013 Hebrew University
Usharani Dandamudi post-doc 2009-2014 Hebrew University
Debasish Mandal post-doc 2013-2017 Hebrew University
David Danovich research scientist 1992- Hebrew University
Croix J. Laconsay research scientist 2016-2017 Institute of Chemistry, The Hebrew University of Jerusalem
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Mo Y, Danovich D, Shaik S. (2022) The roles of charge transfer and polarization in non-covalent interactions: a perspective from ab initio valence bond methods. Journal of Molecular Modeling. 28: 274
Wang B, Zhang X, Fang W, et al. (2022) How Do Metalloproteins Tame the Fenton Reaction and Utilize •OH Radicals in Constructive Manners? Accounts of Chemical Research. 55: 2280-2290
Wang S, Ma P, Shaik S, et al. (2022) Valence-Inverted States of Nickel(II) Complexes Perform Facile C-H Bond Activation. Journal of the American Chemical Society
Wang B, Wu P, Shaik S. (2022) Critical Roles of Exchange and Superexchange Interactions in Dictating Electron Transfer and Reactivity in Metalloenzymes. The Journal of Physical Chemistry Letters. 13: 2871-2877
Yadav S, Shaik S, Siddiqui SA, et al. (2022) Local Electric Fields Dictate Function: The Different Product Selectivities Observed for Fatty Acid Oxidation by Two Deceptively Very Similar P450-Peroxygenases OleT and BSβ. Journal of Chemical Information and Modeling
Kalita S, Shaik S, Dubey KD. (2021) MD simulations and QM/MM calculations reveal the key mechanistic elements which are responsible for the efficient C-H amination reaction performed by a bioengineered P450 enzyme. Chemical Science. 12: 14507-14518
Pomogaev V, Lee S, Shaik S, et al. (2021) Exploring Dyson's Orbitals and Their Electron Binding Energies for Conceptualizing Excited States from Response Methodology. The Journal of Physical Chemistry Letters. 9963-9972
Joy J, Danovich D, Shaik S. (2021) Nature of the Trigger Linkage in Explosive Materials Is a Charge-Shift Bond. The Journal of Organic Chemistry. 86: 15588-15596
Feng J, Shaik S, Wang B. (2021) Spin-regulated Electron Transfer and Exchange-enhanced Reactivity in Fe4S4-mediated Redox Reaction of the Dph2 Enzyme During the Biosynthesis of Diphthamide. Angewandte Chemie (International Ed. in English)
Shaik S, Danovich D, Hiberty PC. (2021) Valence Bond Theory-Its Birth, Struggles with Molecular Orbital Theory, Its Present State and Future Prospects. Molecules (Basel, Switzerland). 26
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