Mariana Zancan Tonel

6PUBLICATIONS
22CO-AUTHORS
Surface water quality processes and contaminated sediment assessmentElectrical energy generation (incl. renewables, excl. photovoltaics)Biomolecular modelling and designChemical thermodynamics and energeticsTheoretical quantum chemistry
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Publications (6)

|Feb 16, 2026
Computational Investigation of 4‑Nitrophenol Inclusion Complexes with α‑, β‑, and γ‑Cyclodextrins.

Laura Fernanda Osmari Vendrame, Mariana Zancan Tonel, João Augusto Pereira da Rocha

|Jul 21, 2025
Graphene Surface Functionalization with Pyrene-, Acridine-, and Fluorenyl-Linkers for DNA Hybridization Studies Using Electrolyte-Gate Graphene Field Effect Transistors.

Telma Domingues, João Rodrigues, M Fátima Cerqueira

|Jul 07, 2023
Evaluation interaction of graphene oxide with heparin for antiviral blockade: a study of ab initio simulations, molecular docking, and experimental analysis.

André Flores Dos Santos, Mirkos Ortiz Martins, Jerônimo Lameira

|Jun 02, 2023
Ab initio study of water anchored in graphene pristine and vacancy-type defects.

Mariana Zancan Tonel, João Pedro Kleinubing Abal, Solange Binotto Fagan

|Feb 01, 2023
Graphene oxide and flavonoids as potential inhibitors of the spike protein of SARS-CoV-2 variants and interaction between ligands: a parallel study of molecular docking and DFT.

Júlia Vaz Schultz, Mariana Zancan Tonel, Mirkos Ortiz Martins

|May 31, 2021
Theoretical study of small aromatic molecules adsorbed in pristine and functionalised graphene.

Mariana Zancan Tonel, Ivana Zanella, Solange Binotto Fagan

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Frequent Collaborators

4 joint publications

Ivana Zanella da Silva

4 joint publications

Solange Binotto Fagan

2 joint publications

Mirkos Ortiz Martins

1 joint publications

Júlia Vaz Schultz