| MEPSA: minimum energy pathway analysis for energy landscapes I Marcos-Alcalde, J Setoain, JI Mendieta-Moreno, J Mendieta, ... Bioinformatics 31 (23), 3853-3855, 2015 | 107 | 2015 |
| Adsorption orientations and immunological recognition of antibodies on graphene JG Vilhena, AC Dumitru, ET Herruzo, JI Mendieta-Moreno, R Garcia, ... Nanoscale 8 (27), 13463-13475, 2016 | 60 | 2016 |
| The Role of Gln61 in HRas GTP hydrolysis: a quantum mechanics/molecular mechanics study F Martín-García, JI Mendieta-Moreno, E López-Vinas, P Gómez-Puertas, ... Biophysical journal 102 (1), 152-157, 2012 | 57 | 2012 |
| fireball/amber: An Efficient Local-Orbital DFT QM/MM Method for Biomolecular Systems JI Mendieta-Moreno, RC Walker, JP Lewis, P Gómez-Puertas, J Mendieta, ... Journal of Chemical Theory and Computation 10 (5), 2185-2193, 2014 | 52 | 2014 |
| Tailoring π-conjugation and vibrational modes to steer on-surface synthesis of pentalene-bridged ladder polymers B De la Torre, A Matěj, A Sánchez-Grande, B Cirera, B Mallada, ... Nature communications 11 (1), 4567, 2020 | 48 | 2020 |
| Effect of water-DNA interactions on elastic properties of DNA self-assembled monolayers CM Domínguez, D Ramos, JI Mendieta-Moreno, JLG Fierro, J Mendieta, ... Scientific Reports 7 (1), 536, 2017 | 43 | 2017 |
| Strain‐induced isomerization in one‐dimensional metal–organic chains M Telychko, J Su, A Gallardo, Y Gu, JI Mendieta‐Moreno, D Qi, A Tadich, ... Angewandte Chemie 131 (51), 18764-18770, 2019 | 42 | 2019 |
| On-surface strain-driven synthesis of nonalternant non-benzenoid aromatic compounds containing four-to eight-membered rings B Mallada, B de la Torre, JI Mendieta-Moreno, D Nachtigallová, A Matěj, ... Journal of the American Chemical Society 143 (36), 14694-14702, 2021 | 41 | 2021 |
| Two-step ATP-driven opening of cohesin head Í Marcos-Alcalde, JI Mendieta-Moreno, B Puisac, MC Gil-Rodríguez, ... Scientific reports 7 (1), 3266, 2017 | 35 | 2017 |
| Atomic scale control and visualization of topological quantum phase transition in π‐conjugated polymers driven by their length H González‐Herrero, JI Mendieta‐Moreno, S Edalatmanesh, J Santos, ... Advanced Materials 33 (44), 2104495, 2021 | 34 | 2021 |
| Proton transfer in guanine-cytosine base pairs in B-DNA D Soler-Polo, JI Mendieta-Moreno, DG Trabada, J Mendieta, J Ortega Journal of chemical theory and computation 15 (12), 6984-6991, 2019 | 31 | 2019 |
| Quantum mechanics/molecular mechanics free energy maps and nonadiabatic simulations for a photochemical reaction in DNA: cyclobutane thymine dimer JI Mendieta-Moreno, DG Trabada, J Mendieta, JP Lewis, ... The Journal of Physical Chemistry Letters 7 (21), 4391-4397, 2016 | 28 | 2016 |
| Heterochiral recognition among functionalized heptahelicenes on noble metal surfaces A Mairena, JI Mendieta, O Stetsovych, A Terfort, IG Stará, I Starý, P Jelínek, ... Chemical Communications 55 (71), 10595-10598, 2019 | 27 | 2019 |
| Unusual Scaffold Rearrangement in Polyaromatic Hydrocarbons Driven by Concerted Action of Single Gold Atoms on a Gold Surface JI Mendieta‐Moreno, B Mallada, B de la Torre, T Cadart, M Kotora, ... Angewandte Chemie 134 (50), e202208010, 2022 | 19 | 2022 |
| Molecular dynamics simulation of GTPase activity in polymers of the cell division protein FtsZ F Martín-García, E Salvarelli, JI Mendieta-Moreno, M Vicente, ... FEBS letters 586 (8), 1236-1239, 2012 | 19 | 2012 |
| Attomolar detection of hepatitis C virus core protein powered by molecular antenna-like effect in a graphene field-effect aptasensor I Palacio, M Moreno, A Náñez, A Purwidyantri, T Domingues, PD Cabral, ... Biosensors and Bioelectronics 222, 115006, 2023 | 18 | 2023 |
| Significance of nuclear quantum effects in hydrogen bonded molecular chains A Cahlik, J Hellerstedt, JI Mendieta-Moreno, M Svec, VM Santhini, ... ACS nano 15 (6), 10357-10365, 2021 | 18 | 2021 |
| Exploiting Cooperative Catalysis for the On‐Surface Synthesis of Linear Heteroaromatic Polymers via Selective C–H Activation X Liu, A Matej, T Kratky, JI Mendieta‐Moreno, S Günther, P Mutombo, ... Angewandte Chemie International Edition 61 (5), e202112798, 2022 | 17 | 2022 |
| Transition from homochiral clusters to racemate monolayers during 2D crystallization of trioxa [11] helicene on Ag (100) B Irziqat, J Berger, JI Mendieta‐Moreno, MS Sundar, AV Bedekar, ... ChemPhysChem 22 (3), 293-297, 2021 | 13 | 2021 |
| Photo-induced reactions from efficient molecular dynamics with electronic transitions using the FIREBALL local-orbital density functional theory formalism V Zobač, JP Lewis, E Abad, JI Mendieta-Moreno, P Hapala, P Jelínek, ... Journal of Physics: Condensed Matter 27 (17), 175002, 2015 | 10 | 2015 |
Pavel JelínekInstitute of Physics, Czech Academy of Sciences, Czech RepublicVerified email at fzu.cz