Flavio S Emery

24PUBLICATIONS
74CO-AUTHORS
Computational chemistryCheminformatics and quantitative structure-activity relationshipsBiologically active moleculesBiomolecular modelling and designIndustrial molecular engineering of nucleic acids and proteins
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Publications (24)

|Aug 17, 2026
Interpreting Mass Spectrometry Data From Computational Chemistry: A Practical Guide to Reactivity and the Dissociation Mechanisms of 1,4-Naphthoquinone Derivatives.

|Jun 17, 2026
5‑Nitrofuran-Semicarbazone Hybrids as Antitrypanosomal Agents: Structure-Activity Relationship and Nitroreductase Activation.

|Jul 21, 2025
Crystallographic Structure of Human Dihydroorotate Dehydrogenase in Complex with the Natural Product Inhibitor Lapachol.

Aline D Purificação, Laila S Benz, Wemenes J Lima Silva

|Jul 14, 2025
Barbituric Acid Derivatives as Covalent Inhibitors of Leishmania braziliensis Dihydroorotate Dehydrogenase.

Thamires Quadros Froes, Temitayo Omowumi Alegbejo Price, Bruna Fleck Godoi

|May 05, 2025
Fragment Libraries from Large and Novel Synthetic Compounds and Natural Products: A Comparative Chemoinformatic Analysis.

Verónica Ramírez-Cid, Ana L Chávez-Hernández, Osvaldo Sánchez López

|Feb 10, 2025
Fragment Screening Reveals Novel Scaffolds against Sirtuin-2-Related Protein 1 from Trypanosoma brucei.

Renan A Gomes, Marcelo D Polêto, Hugo Verli

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Frequent Collaborators

7 joint publications

Daniel Gedder Silva

4 joint publications

Gustavo Henrique Goulart Trossini

4 joint publications

Maria Cristina Nonato

4 joint publications

Carolina Horta Andrade