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Francisco Nithael Melo Lúcio

Universidade Estadual do Ceará · CE · 12 publicações em 2023–2026

ORCID 0000-0002-3652-1102

Computational Drug Discovery MethodsAdvanced Chemical Physics StudiesHeterocyclic Compound Synthesis and BioactivityCholinesterase and Neurodegenerative DiseasesCrystal structures of chemical compounds

Principais coautores no Nordeste tamanho = publicações em comum

Emmanuel Silva Marinho Márcia Machado Marinho Matheus Nunes da Rocha Hélcio Silva dos Santos Victor Moreira de Oliveira Caio Henrique Alexandre Roberto Akenaton Onassis Cardoso Viana Gomes Alexandre Magno Rodrigues Teixeira Damião Sampaio de Sousa Francisco Ferdinando Mesquita Cajazeiras Pedro de Lima‐Neto Selene Maia de Morais

Publicações recentes

2026 5

Coumarin-based multimodal dual-target ligands for MAOB and 5-HT2CR: DFT analysis, QED scoring, molecular docking, and narcosis evaluation
Farmacologia e toxicologia · Journal of the Iranian Chemical Society
Natural chlocarbazomycins as potential adenosine A1 receptor antagonists: ligand-based and structure-based virtual screening, quantum chemical analysis and CNS MPO study
Farmacologia e toxicologia · Molecular Diversity
Integrated quantum chemical calculations and in silico approach to the anxiolytic effects of campesterol and its derivatives, with evaluation of locomotor activity in adult zebrafish (Danio rerio)
Bioquímica, genética e biologia molecular · Chemical Papers
Evaluation of Chalcone ( E )-3-(4-Fluorophenyl)-1-(2-hydroxy-3,4,6-trimethoxyphenyl)-prop-2-en-1-one against Trypanosoma cruzi (Y Strain): In Vitro Assay, In Silico Drug-Target Analysis, and MPO-Based Drug Likeness
Medicina · ACS Omega
Antibiofilm biosynthetic terpene derivatives against clinically and food-relevant bacteria, including synergistic interactions with β -lactam antibiotics: quantum chemical calculations, molecular docking and ADMET study
Ciências agrárias e biológicas · Biofouling

2025 4

Coumarin benzamide scaffold as potential 5-HT2C inhibitors: a multiparametric investigation and molecular simulation
Farmacologia e toxicologia · Journal of Molecular Modeling
Allosteric modulation of laeviganoid-based clerodane diterpenes derivatives in muscarinic acetylcholine M1 receptor against tinnitus: a structure-based virtual screening approach
Farmacologia e toxicologia · Future Journal of Pharmaceutical Sciences
Unveiling the therapeutic potential of thioimidazolidinones: A combined approach using quantum chemical calculations, in silico studies, and in vivo research in zebrafish for anxiolytic and anticonvulsant drug discovery
Farmacologia e toxicologia · Journal of Molecular Structure
Atividade antifúngica e toxicidade de chalconas frente à Candida auris: uma abordagem computacional
Farmacologia e toxicologia · Journal of Health & Biological Sciences

2024 2

Structure-based virtual screening of mangiferin derivatives with antidiabetic action: a molecular docking and dynamics study and MPO-based drug-likeness approach
Medicina · 3 Biotech
Structural Characterization, Dft Calculations, Admet Studies, Antibiotic Potentiating Activity, Evaluation of Efflux Pump Inhibition of Hydrazone Derivative of the Drug Hydralazine
Medicina · SSRN Electronic Journal

2023 1

Insights of structure-based virtual screening and MPO-based SAR analysis of berberine-benzimidazole derivatives against Parkinson disease
Farmacologia e toxicologia · Journal of Molecular Structure

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