| Molecular Dynamic Simulation of Oxaliplatin Diffusion in Poly(lactic acid‐co‐glycolic acid). Part A: Parameterization and Validation of the Force‐Field CVFF J Lange, FG de Souza, M Nele, FW Tavares, ISV Segtovich, GCQ da Silva, ... Macromolecular Theory and Simulations 25 (1), 45-62, 2016 | 56 | 2016 |
| Are all-atom any better than united-atom force fields for the description of liquid properties of alkanes? GCQ da Silva, GM Silva, FW Tavares, FP Fleming, BAC Horta Journal of Molecular Modeling 26, 1-17, 2020 | 41 | 2020 |
| Solvent effects on the decarboxylation of trichloroacetic acid: insights from ab initio molecular dynamics simulations GCQ da Silva, TM Cardozo, GW Amarante, CRA Abreu, BAC Horta Physical Chemistry Chemical Physics 20 (34), 21988-21998, 2018 | 23 | 2018 |
| Are all-atom any better than united-atom force fields for the description of liquid properties of alkanes? 2. A systematic study considering different chain lengths GCQ da Silva, GM Silva, FW Tavares, FP Fleming, BAC Horta Journal of Molecular Liquids 354, 118829, 2022 | 10 | 2022 |
| Unveiling Liquid‐Phase Exfoliation of Graphite and Boron Nitride Using Fluorescent Dyes Through Combined Experiments and Simulations Y He, X Qian, GCQ da Silva, C Gabellini, MA Lucherelli, G Biagiotti, ... Small, 2307817, 2024 | 7 | 2024 |
| Effects of paraffin, fatty acid and long alkyl chain phenol on the solidification of n-hexadecane under harsh subcooling condition: A molecular dynamics simulation study GCQ da Silva, FG Oliveira, WF de Souza, MCK de Oliveira, PM Esteves, ... Fuel 285, 119029, 2021 | 7 | 2021 |
| Effects of additives on oil displacement in nanocapillaries: A mesoscale simulation study GCQ da Silva, R Giro, BAC Horta, RF Neumann, M Engel, MB Steiner Journal of Molecular Liquids 312, 112953, 2020 | 6 | 2020 |
| A Multiscale Approach to Simulation of Fluid Flow in Tight Porous Media R Giro, PW Bryant, G Carneiro Queiroz da Silva, RF Neumann, M Engel, ... SPE Argentina Exploration and Production of Unconventional Resources Symposium, 2018 | 4 | 2018 |
| When less is more: does more Na+-cations mean more adsorption sites for toluene in faujasites? GCQ da Silva, JM Simon, JM Salazar Physical Chemistry Chemical Physics 25 (11), 8028-8042, 2023 | 2 | 2023 |