Chemi-and bioluminescence of cyclic peroxides M Vacher, I Fdez. Galván, BW Ding, S Schramm, R Berraud-Pache, ... Chemical reviews 118 (15), 6927-6974, 2018 | 304 | 2018 |
The chemistry of bioluminescence: an analysis of chemical functionalities I Navizet, YJ Liu, N Ferré, D Roca‐Sanjuán, R Lindh ChemPhysChem 12 (17), 3064-3076, 2011 | 149 | 2011 |
Color-tuning mechanism of firefly investigated by multi-configurational perturbation method I Navizet, YJ Liu, N Ferré, HY Xiao, WH Fang, R Lindh Journal of the American Chemical Society 132 (2), 706-712, 2010 | 133 | 2010 |
Systematic theoretical investigation on the light emitter of firefly SF Chen, YJ Liu, I Navizet, N Ferré, WH Fang, R Lindh Journal of Chemical Theory and Computation 7 (3), 798-803, 2011 | 94 | 2011 |
Myosin flexibility: structural domains and collective vibrations I Navizet, R Lavery, RL Jernigan Proteins: Structure, Function, and Bioinformatics 54 (3), 384-393, 2004 | 66 | 2004 |
Chemiluminescence and fluorescence states of a small model for coelenteramide and cypridina oxyluciferin: a CASSCF/CASPT2 study D Roca-Sanjuán, MG Delcey, I Navizet, N Ferre, YJ Liu, R Lindh Journal of Chemical Theory and Computation 7 (12), 4060-4069, 2011 | 55 | 2011 |
Aequorea’s secrets revealed: New fluorescent proteins with unique properties for bioimaging and biosensing GG Lambert, H Depernet, G Gotthard, DT Schultz, I Navizet, T Lambert, ... PLoS biology 18 (11), e3000936, 2020 | 53 | 2020 |
Are the bio‐and chemiluminescence states of the firefly oxyluciferin the same as the fluorescence state? I Navizet, D Roca‐Sanjuán, L Yue, YJ Liu, N Ferré, R Lindh Photochemistry and Photobiology 89 (2), 319-325, 2013 | 51 | 2013 |
Probing protein mechanics: residue-level properties and their use in defining domains I Navizet, F Cailliez, R Lavery Biophysical journal 87 (3), 1426-1435, 2004 | 50 | 2004 |
Molecular simulations with in-deMon2k QM/MM, a tutorial-review A de La Lande, A Alvarez-Ibarra, K Hasnaoui, F Cailliez, X Wu, T Mineva, ... Molecules 24 (9), 1653, 2019 | 49 | 2019 |
Chemiluminescence of coelenterazine and fluorescence of coelenteramide: a systematic theoretical study SF Chen, I Navizet, D Roca-Sanjuan, R Lindh, YJ Liu, N Ferre Journal of Chemical Theory and Computation 8 (8), 2796-2807, 2012 | 49 | 2012 |
Simulation and analysis of the spectroscopic properties of oxyluciferin and its analogues in water C Garcia-Iriepa, P Gosset, R Berraud-Pache, M Zemmouche, G Taupier, ... Journal of Chemical Theory and Computation 14 (4), 2117-2126, 2018 | 44 | 2018 |
Hybrid QM/MM simulations of the obelin bioluminescence and fluorescence reveal an unexpected light emitter S Chen, I Navizet, R Lindh, Y Liu, N Ferre The Journal of Physical Chemistry B 118 (11), 2896-2903, 2014 | 36 | 2014 |
Spectrochemistry of firefly bioluminescence MB Al-Handawi, S Polavaram, A Kurlevskaya, P Commins, S Schramm, ... Chemical reviews 122 (16), 13207-13234, 2022 | 34 | 2022 |
Frontiers in multiscale modeling of photoreceptor proteins M Mroginski, S Adam, GS Amoyal, A Barnoy, A Bondar, VA Borin, ... Photochemistry and photobiology 97 (2), 243-269, 2021 | 31 | 2021 |
Beetle luciferases with naturally red-and blue-shifted emission C Carrasco-López, JC Ferreira, NM Lui, S Schramm, R Berraud-Pache, ... Life science alliance 1 (4), 2018 | 29 | 2018 |
The Light Emitter of the 2‐Coumaranone Chemiluminescence: Theoretical and Experimental Elucidation of a Possible Model for Bioluminescent Systems S Schramm, I Navizet, P Naumov, NK Nath, R Berraud‐Pache, P Oesau, ... European Journal of Organic Chemistry 2016 (4), 678-681, 2016 | 29 | 2016 |
Important fluctuation dynamics of large protein structures are preserved upon coarse‐grained renormalization P Doruker, RL Jernigan, I Navizet, R Hernandez International journal of quantum chemistry 90 (2), 822-837, 2002 | 27 | 2002 |
QM/MM calculations on a newly synthesised oxyluciferin substrate: new insights into the conformational effect R Berraud-Pache, I Navizet Physical Chemistry Chemical Physics 18 (39), 27460-27467, 2016 | 26 | 2016 |
The role of solvation models on the computed absorption and emission spectra: the case of fireflies oxyluciferin C García-Iriepa, M Zemmouche, M Ponce-Vargas, I Navizet Physical Chemistry Chemical Physics 21 (8), 4613-4623, 2019 | 25 | 2019 |