Marina Macchiagodena

Identification of potential binders of the main protease 3CLpro of the COVID-19 via structure-based ligand design and molecular modeling

Marina Macchiagodena, Marco Pagliai, Piero Procacci · Chemical Physics Letters · 2020 · 174 citations · Full text

Structure-based Ligand Design, Biochemistry, Biomolecular Structure Prediction +10

Triphilic Ionic‐Liquid Mixtures: Fluorinated and Non‐fluorinated Aprotic Ionic‐Liquid Mixtures

Oldamur Hollóczki, Marina Macchiagodena, Henry Weber et al. · ChemPhysChem · 2015 · 138 citations · Full text

Liquid structure of 1-alkyl-3-methylimidazolium-hexafluorophosphates by wide angle x-ray and neutron scattering and molecular dynamics

Marina Macchiagodena, Lorenzo Gontrani, Fabio Ramondo et al. · The Journal of Chemical Physics · 2011 · 83 citations · Full text

X-ray Crystallography, Materials Science, Crystal Structure +15

Upgrading and Validation of the AMBER Force Field for Histidine and Cysteine Zinc(II)-Binding Residues in Sites with Four Protein Ligands

Marina Macchiagodena, Marco Pagliai, Claudia Andreini et al. · Journal of Chemical Information and Modeling · 2019 · 66 citations

Cysteine Zinc, Protein Assembly, Molecular Biology +20

Mycotoxins aptasensing: From molecular docking to electrochemical detection of deoxynivalenol

Hasret Subak, Giulia Selvolini, Marina Macchiagodena et al. · Bioelectrochemistry · 2020 · 48 citations

Biochemistry, Bioelectrochemistry, Electrochemical Detection +6