| Mechanism and reactivity in the Morita–Baylis–Hillman reaction: the challenge of accurate computations Z Liu, C Patel, JN Harvey, RB Sunoj Physical Chemistry Chemical Physics 19 (45), 30647-30657, 2017 | 84 | 2017 |
| Mechanistic Insights and the Role of Cocatalysts in Aza-Morita− Baylis− Hillman and Morita− Baylis− Hillman Reactions D Roy, C Patel, RB Sunoj The Journal of Organic Chemistry 74 (18), 6936-6943, 2009 | 83 | 2009 |
| Insights into Intrastrand Cross-Link Lesions of DNA from QM/MM Molecular Dynamics Simulations J Garrec, C Patel, U Rothlisberger, E Dumont Journal of the American Chemical Society 134 (4), 2111-2119, 2012 | 76 | 2012 |
| Hypercoordinate Iodine Catalysts in Enantioselective Transformation: The Role of Catalyst Folding in Stereoselectivity A Sreenithya, C Patel, CM Hadad, RB Sunoj ACS Catalysis 7 (6), 4189-4196, 2017 | 45 | 2017 |
| Understanding the structural basis of substrate recognition by Plasmodium falciparum plasmepsin V to aid in the design of potent inhibitors RK Bedi, C Patel, V Mishra, H Xiao, RY Yada, P Bhaumik Scientific reports 6 (1), 1-17, 2016 | 30 | 2016 |
| What Singles Out the G [8–5] C Intrastrand DNA Cross-Link? Mechanistic and Structural Insights from Quantum Mechanics/Molecular Mechanics Simulations C Patel, J Garrec, C Dupont, E Dumont Biochemistry 52 (2), 425-431, 2013 | 26 | 2013 |
| Addressing the competitive formation of tandem DNA lesions by a nucleobase peroxyl radical: a DFT-D screening C Dupont, C Patel, JL Ravanat, E Dumont Organic & biomolecular chemistry 11 (18), 3038-3045, 2013 | 26 | 2013 |
| TiCl4-Promoted Baylis−Hillman Reaction: Mechanistic Rationale toward Product Distribution and Stereoselectivity C Patel, RB Sunoj The Journal of organic chemistry 75 (2), 359-367, 2010 | 26 | 2010 |
| Improved DFT Description of Intrastrand Cross-Link Formation by Inclusion of London Dispersion Corrections C Dupont, C Patel, E Dumont The Journal of Physical Chemistry B 115 (50), 15138-15144, 2011 | 23 | 2011 |
| Mechanistic Insights and the Origin of Regioselective Borylation in an Iridium-Catalyzed Alkyl C(sp3)–H Bond Functionalization C Patel, V Abraham, RB Sunoj Organometallics 36 (1), 151-158, 2017 | 13 | 2017 |
| Probing intramolecular interactions in arylselenides using a property descriptor based approach D Roy, C Patel, JF Liebman, RB Sunoj The Journal of Physical Chemistry A 112 (37), 8797-8803, 2008 | 11 | 2008 |
| Structure, Dynamics, and Interactions of a C4′-Oxidized Abasic Site in DNA: A Concomitant Strand Scission Reverses Affinities C Patel, T Dršata, F Lankaš, E Dumont Biochemistry 52 (45), 8115-8125, 2013 | 9 | 2013 |
| Revisiting the Use of Quantum Chemical Calculations in LogPoctanol-water Prediction D Roy, C Patel Molecules 28 (2), 801, 2023 | 6 | 2023 |
| A Computational Study of Molecular Mechanism of Chloroquine Resistance by Chloroquine Resistance Transporter Protein of Plasmodium falciparum via Molecular Modeling and … C Patel, D Roy Physchem 1 (3), 232-242, 2021 | 5 | 2021 |
| Activation mechanism of plasmepsins, pepsin‐like aspartic proteases from Plasmodium, follows a unique trans‐activation pathway I Rathore, V Mishra, C Patel, H Xiao, A Gustchina, A Wlodawer, RY Yada, ... The FEBS Journal 288 (2), 678-698, 2021 | 5 | 2021 |
| Octanol–Water Partition Coefficients of Fluorinated Drug Molecules with Continuum Solvation Models C Patel, D Roy The Journal of Physical Chemistry A, 2022 | 4 | 2022 |
| Structural insights into the mechanism of Plasmepsins from P. falciparum I Rathore, V Mishra, C Patel, H Xiao, R Yada, A Gustchina, A Wlodawer, ... ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES 73, C166-C166, 2017 | | 2017 |
Elise DumontProfessor in Chemistry, Institut de Chimie de Nice, Université Côte d’AzurVerified email at univ-cotedazur.fr
