| Lipid peroxidation in membranes: the peroxyl radical does not “float” J Garrec, A Monari, X Assfeld, LM Mir, M Tarek The Journal of Physical Chemistry Letters 5 (10), 1653-1658, 2014 | 89 | 2014 |
| 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 |
| Understanding the HIV-1 protease reactivity with DFT: what do we gain from recent functionals? J Garrec, P Sautet, P Fleurat-Lessard The Journal of Physical Chemistry B 115 (26), 8545-8558, 2011 | 32 | 2011 |
| β‐Lactam Synthesis through Diodomethane Addition to Amide Dianions A Zidan, J Garrec, M Cordier, AM El‐Naggar, NEA Abd El‐Sattar, AK Ali, ... Angewandte Chemie 129 (40), 12347-12351, 2017 | 30 | 2017 |
| Pushing the frontiers of first-principles based computer simulations of chemical and biological systems E Brunk, I Tavernelli, S Vanni, TJ Penfold, G Palermo, M Neri, ... Chimia 65 (9), 667-671, 2011 | 27 | 2011 |
| 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 |
| Two misfolding routes for the prion protein around pH 4.5 J Garrec, I Tavernelli, U Rothlisberger PLoS computational biology 9 (5), e1003057, 2013 | 23 | 2013 |
| Palladium‐Catalyzed C8‐Arylation of Naphthalenes through C− H Activation: A Combined Experimental and Computational Study J Garrec, M Cordier, G Frison, S Prévost Chemistry–A European Journal 25 (63), 14441-14446, 2019 | 18 | 2019 |
| Passerini–Smiles Reaction of α‐Ketophosphonates: Platform for Phospha‐Brook/Smiles Embedded Cascades C Cheibas, N Fincias, N Casaretto, J Garrec, L El Kaïm Angewandte Chemie International Edition 61 (11), e202116249, 2022 | 16 | 2022 |
| A palladium-catalyzed oxa-(4+ 4)-cycloaddition strategy towards oxazocine scaffolds A Scuiller, X Liu, M Cordier, J Garrec, A Archambeau Synlett 32 (10), 981-986, 2021 | 14 | 2021 |
| Temperature and pressure dependent rate coefficients for the reaction of ketene with hydroxyl radical B Xu, J Garrec, A Nicolle, M Matrat, L Catoire The Journal of Physical Chemistry A 123 (13), 2483-2496, 2019 | 14 | 2019 |
| Enhanced Sampling Molecular Dynamics Identifies PrPSc Structures Harboring a C-Terminal β-Core P Baillod, J Garrec, MC Colombo, I Tavernelli, U Rothlisberger Biochemistry 51 (49), 9891-9899, 2012 | 13 | 2012 |
| Low inhibiting power of N··· CO based peptidomimetic compounds against HIV-1 protease: insights from a QM/MM study J Garrec, M Cascella, U Rothlisberger, P Fleurat-Lessard Journal of Chemical Theory and Computation 6 (4), 1369-1379, 2010 | 10 | 2010 |
| Prion versus doppel protein misfolding: new insights from replica-exchange molecular dynamics simulations P Baillod, J Garrec, I Tavernelli, U Rothlisberger Biochemistry 52 (47), 8518-8526, 2013 | 7 | 2013 |
| 5‐endo‐dig Cyclization of O‐Propargyl Mandelic Acid Amides towards 2,5‐Dihydrofurans LB Gaied, N Fincias, J Garrec, LE Kaïm European Journal of Organic Chemistry 2019 (47), 7656-7665, 2019 | 6 | 2019 |
| Are Dinucleoside Monophosphates Relevant Models for the Study of DNA Intrastrand Cross-Link Lesions? The Example of G [8–5m] T J Garrec, E Dumont Chemical Research in Toxicology 27 (7), 1133-1141, 2014 | 5 | 2014 |
| Palladium‐Catalyzed Regioselective peri‐ and ortho‐Halogenation of 1‐Naphthaldehydes: Application to the Synthesis of Polycyclic Natural Product Skeletons H Amistadi‐Revol, J Garrec, N Casaretto, S Prévost European Journal of Organic Chemistry 26 (24), e202300359, 2023 | 3 | 2023 |
| An updated empirical correlation formalism for laminar flame speeds: Application to a TRFE gasoline surrogate in highly diluted conditions B Xu, P Diévart, M Matrat, J Garrec, L Catoire Fuel 324, 124682, 2022 | 3 | 2022 |
| Metal-Free Addition of Boronic Acids to Silylnitronates MD Kerim, P Boyode, J Garrec, L El Kaïm Synlett 31 (09), 856-860, 2020 | 1 | 2020 |
| Predictions of gas phase thermochemical properties and solvation free energies from ab initio calculation. Applications the thermal decomposition of biomass. CN Saidi, DC Mielczarek, J Garrec, P Paricaud, L Catoire Thermodynamics 2019, 2019 | 1 | 2019 |
Elise DumontProfessor in Chemistry, Institut de Chimie de Nice, Université Côte d’AzurVerified email at univ-cotedazur.fr
