Karen C. Weber

Universidade Federal da Paraíba — Brazil

Computer Science · Physical Sciences

17h-index5.7kcitations100works1.62yr avg
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Research Topics

Computational Drug Discovery Methods(20), Research on Leishmaniasis Studies(10), Synthesis and biological activity(9), Chemistry Education and Research(9), Science and Education Research(8)

Publications100 total

Insights into a new class of antileishmanial compounds: an in vitro and in silico study of 1,2,4-oxadiazol-5(4H)-one derivatives
SSRN Electronic Journal·2026Open Access
Computational insights into terpene-induced modulation of amyloid-β peptide (Aβ1–42) aggregation-favoring conformations
Journal of Molecular Graphics and Modelling·2025
Cu-, Zn-melophen or salophen complexes? Comparative prediction of the first-order molecular hyperpolarizability based on a DFT approach
Molecular Physics·2025
Design, in silico study, and efficient synthesis of N-acylhydrazones in deep eutectic solvents: potential anticonvulsant agents
Bioorganic & Medicinal Chemistry·2025· 1 cited
DynamiSpectra: A Python Software Package and Web Platform for Molecular Dynamics Data Analysis in Computational Biology
Journal of Chemical Information and Modeling·2025· 2 citedOpen Access
In silico target identification and pharmacokinetic profiling of 2-aryl-quinoline-4-carboxylic acid derivatives as potential antileishmanial agents
Frontiers in Pharmacology·2025· 1 citedOpen Access
In Vitro and <i>In Silico</i> Evaluation of Isatin‐Derived Spirooxindoles as Antituberculosis Drug Candidates
Chemical Biology & Drug Design·2025· 2 citedOpen Access
Solvatochromic fluorophores based on 6-fluoro-2-(aryl)quinoline-4-carboxylic acids: Synthesis, optical studies and evaluation of their antimicrobial and larvicidal properties
Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy·2025· 4 cited
Cu-, Zn-melophen or salophen complexes? Comparative prediction of the first-order molecular hyperpolarizability based on a DFT approach
Figshare·2025Open Access
Cu-, Zn-melophen or salophen complexes? Comparative prediction of the first-order molecular hyperpolarizability based on a DFT approach
Figshare·2025Open Access
<i>In Silico</i> Structural Insights and Potential Inhibitor Identification Based on the Benzothiazole Core for Targeting <i>Leishmania major</i> Pteridine Reductase 1
ACS Omega·2024· 2 citedOpen Access
Current trends to design antimalarial drugs targeting <i>N</i> -myristoyltransferase
Future Microbiology·2024· 5 cited
Biological properties and in silico studies of thiazolopyrimidine derivatives active against visceral and cutaneous Leishmania spp. amastigote forms
European Journal of Medicinal Chemistry Reports·2024· 1 citedOpen Access
2-Styryl-quinoline-4-carboxylic acids: Synthesis, characterization, and investigation of their optical properties and antimicrobial activity
Dyes and Pigments·2024· 5 cited
Flipped Classroom and Station Rotation Model: A Brief Review of Their Applications in Science Teaching
Revista Virtual de Química·2023· 2 citedOpen Access
Acidificação dos Oceanos: Proposta e Análise de uma Sequência Didática com Enfoque CTSA em Aulas de Química
Revista Debates em Ensino de Química·2022· 1 citedOpen Access
“Chernobyl ataca” e “Nobel ou nada”: utilizando jogos didáticos para o ensino de radioatividade e tabela periódica.
Anais do 20º Encontro Nacional de Ensino de Química (ENEQ Pernambuco)·2021
Inclusive education in Chemistry Teaching: an analysis in national journals
Revista Educação Especial·2020Open Access
Educação inclusiva no Ensino de Química: uma análise em periódicos nacionais
Revista Educação Especial·2020· 14 citedOpen Access
In silico Studies on the Interaction Between Bioactive Ligands and DPPIV: Insights on Potential Candidates for the Treatment of type 2 Diabetes Mellitus
Medicinal Chemistry·2020· 1 citedOpen Access
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Frequent Co-authors

Káthia M. Honório(17), Albérico B. F. da Silva(16), Adriano D. Andricopulo(7), D. G. Frazer(5), Agnaldo Arroio(5), Vinícius Gonçalves Maltarollo(5), Paula Homem‐de‐Mello(4), Norka Beatriz Huaman Lozano(4), Rafael V. C. Guido(4), Jéssika de Oliveira Viana(4), Virgil Mathiowetz(3), Gloria Volland(3), Nancy Kashman(3), Peter W. Stengel(3), Edilson Beserra de Alencar Filho(3), Emmanuela Ferreira de Lima(3), Cláudio Gabriel Lima-Júnior(3), Rodrigo Cristiano(3), G. Franz(2), Aline Thaís Bruni(2)