| E/Z Photochemical switches: syntheses, properties and applications C García-Iriepa, M Marazzi, LM Frutos, D Sampedro RSC Advances 3 (18), 6241-6266, 2013 | 101 | 2013 |
| Mechanism and Scope of Phosphinidene Transfer from Dibenzo-7-phosphanorbornadiene Compounds WJ Transue, A Velian, M Nava, C Garcia-Iriepa, M Temprado, ... Journal of the American Chemical Society 139 (31), 10822-10831, 2017 | 94 | 2017 |
| Rational Design and Synthesis of Efficient Sunscreens To Boost the Solar Protection Factor R Losantos, I Funes‐Ardoiz, J Aguilera, E Herrera‐Ceballos, ... Angewandte Chemie International Edition 56 (10), 2632-2635, 2017 | 80 | 2017 |
| Molecular Basis of SARS-CoV-2 Infection and Rational Design of Potential Antiviral Agents: Modeling and Simulation Approaches A Francés-Monerris, C Hognon, T Miclot, C García-Iriepa, I Iriepa, ... Journal of Proteome Research, 2020 | 70 | 2020 |
| Chiral hydrogen bond environment providing unidirectional rotation in photoactive molecular motors C García-Iriepa, M Marazzi, F Zapata, A Valentini, D Sampedro, LM Frutos The journal of physical chemistry letters 4 (9), 1389-1396, 2013 | 65 | 2013 |
| Tetrahydropyranodiquinolin-8-amines as new, non hepatotoxic, antioxidant, and acetylcholinesterase inhibitors for Alzheimer's disease therapy Y Dgachi, O Sokolov, V Luzet, J Godyń, D Panek, A Bonet, H Martin, ... European Journal of Medicinal Chemistry 126, 576-589, 2017 | 45 | 2017 |
| 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 | 42 | 2019 |
| Simulation and Analysis of the Spectroscopic Properties of Oxyluciferin and Its Analogues in Water C García-Iriepa, P Gosset, R Berraud-Pache, M Zemmouche, G Taupier, ... Journal of chemical theory and computation 14 (4), 2117-2126, 2018 | 42 | 2018 |
| Hydantoin-Based Molecular Photoswitches D Martinez-Lopez, ML Yu, C García-Iriepa, PJ Campos, LM Frutos, ... The Journal of organic chemistry 80 (8), 3929-3939, 2015 | 41 | 2015 |
| Thermodynamics of the Interaction between the Spike Protein of Severe Acute Respiratory Syndrome Coronavirus-2 and the Receptor of Human Angiotensin-Converting Enzyme 2 … C García-Iriepa, C Hognon, A Francés-Monerris, I Iriepa, T Miclot, ... The journal of physical chemistry letters 11, 9272-9281, 2020 | 34 | 2020 |
| Role of RNA Guanine Quadruplexes in Favoring the Dimerization of SARS Unique Domain in Coronaviruses C Hognon, T Miclot, CG Iriepa, A France-Monerris, S Grandemange, ... bioRxiv, 2020 | 29 | 2020 |
| Level of Theory and Solvent Effects on DASA Absorption Properties Prediction: Comparing TD-DFT, CASPT2 and NEVPT2 C García-Iriepa, M Marazzi Materials 10 (9), 1025, 2017 | 26 | 2017 |
| 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 |
| Optomechanical Control of Quantum Yield in Trans–Cis Ultrafast Photoisomerization of a Retinal Chromophore Model A Valentini, D Rivero, F Zapata, C García‐Iriepa, M Marazzi, R Palmeiro, ... Angewandte Chemie International Edition 56 (14), 3842-3846, 2017 | 25 | 2017 |
| From Light Absorption to Cyclization: Structure and Solvent Effects in Donor‐Acceptor Stenhouse Adducts MMDS Cristina García‐Iriepa ChemPhotoChem, 2019 | 22 | 2019 |
| A biomimetic molecular switch at work: coupling photoisomerization dynamics to peptide structural rearrangement C García-Iriepa, M Gueye, J Léonard, D Martínez-López, PJ Campos, ... Physical Chemistry Chemical Physics 18 (9), 6742-6753, 2016 | 21 | 2016 |
| Simulating the Electronic Circular Dichroism Spectra of Photoreversible Peptide Conformations H Gattuso, C García-Iriepa, D Sampedro, A Monari, M Marazzi Journal of chemical theory and computation 13 (7), 3290-3296, 2017 | 17 | 2017 |
| Light emission colour modulation study of oxyluciferin synthetic analogues via QM and QM/MM approaches M Zemmouche, C García-Iriepa, I Navizet Physical Chemistry Chemical Physics, 2020 | 16 | 2020 |
| Photoreactivity Control Mediated by Molecular Force Probes in Stilbene C García-Iriepa, D Sampedro, F Mendicuti, J Léonard, LM Frutos The journal of physical chemistry letters 10 (5), 1063-1067, 2019 | 16 | 2019 |
| Study of Model Systems for Bilirubin and Bilin Chromophores: Determination and Modification of Thermal and Photochemical Properties C García-Iriepa, HA Ernst, Y Liang, AN Unterreiner, LM Frutos, ... The Journal of Organic Chemistry 81 (15), 6292-6302, 2016 | 16 | 2016 |
