| Molecular dynamics simulations of cRGD-conjugated PEGylated TiO2 nanoparticles for targeted photodynamic therapy P Siani, G Frigerio, E Donadoni, C Di Valentin Journal of Colloid and Interface Science 627, 126-141, 2022 | 12 | 2022 |
| Multi-scale modeling of folic acid-functionalized TiO 2 nanoparticles for active targeting of tumor cells E Donadoni, P Siani, G Frigerio, C Di Valentin Nanoscale 14 (33), 12099-12116, 2022 | 12 | 2022 |
| Metadynamics simulations for the investigation of drug loading on functionalized inorganic nanoparticles S Motta, P Siani, E Donadoni, G Frigerio, L Bonati, C Di Valentin Nanoscale 15 (17), 7909-7919, 2023 | 5 | 2023 |
| Modeling zeta potential for nanoparticles in solution: water flexibility matters P Siani, G Frigerio, E Donadoni, C Di Valentin The Journal of Physical Chemistry C 127 (19), 9236-9247, 2023 | 4 | 2023 |
| Molecular Dynamics for the Optimal Design of Functionalized Nanodevices to Target Folate Receptors on Tumor Cells E Donadoni, G Frigerio, P Siani, S Motta, J Vertemara, L De Gioia, ... ACS Biomaterials Science & Engineering 9 (11), 6123-6137, 2023 | 2 | 2023 |
| Mechanism of RGD-conjugated nanodevice binding to its target protein integrin α V β 3 by atomistic molecular dynamics and machine learning G Frigerio, E Donadoni, P Siani, J Vertemara, S Motta, L Bonati, ... Nanoscale 16 (8), 4063-4081, 2024 | 1 | 2024 |
| Mechanism of a nanodevice binding to its target protein by atomistic molecular dynamics: the case of RGD-conjugated PEGylated TiO2 nanoparticles binding to integrins αVβ3 G Frigerio, P Siani, E Donadoni, C DI VALENTIN | | 2024 |
| The effect of polymer coating on nanoparticles’ interaction with lipid membranes studied by coarse-grained molecular dynamics simulations E Donadoni, P Siani, G Frigerio, C Milani, Q Cui, C Di Valentin Nanoscale 16 (18), 9108-9122, 2024 | | 2024 |
| Molecular dynamics simulations of cRGD-conjugated PEGylated TiO2 nanoparticles for targeted photodynamic therapy G Frigerio, P Siani, E Donadoni, C Di Valentin book of abstracts, 9-9, 2023 | | 2023 |
