Identification of novel Aedes aegypti odorant-binding protein 1 modulators by ligand and structure-based approaches and bioassays-Reference-Cited by-同舟云学术

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Identification of novel Aedes aegypti odorant-binding protein 1 modulators by ligand and structure-based approaches and bioassays

Published:2020-08-20 Issue:1 Volume:40 Page:117-129
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Neto Moysés Fagundes de Araújo¹,Santos Cleydson Breno Rodrigues dos²,Magalhães-Junior Jairo Torres³,Leite Franco Henrique Andrade¹^ORCID

Affiliation:

1. Laboratório de Modelagem Molecular, Departamento de Saúde, Universidade Estadual de Feira de Santana, Bahia, Brasil

2. Laboratório de Modelagem e Química Computacional, Departamento de Ciências Biológicas e da Saúde, Universidade Federal do Amapá, Macapá, Brasil

3. Centro Multidisciplinar do Campus de Barra da Universidade Federal do Oeste da Bahia, Bahia, Brasil

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2020.1808074

Reference64 articles.

1. H++ 3.0: automating pK prediction and the preparation of biomolecular structures for atomistic molecular modeling and simulations

2. Molecular dynamics with coupling to an external bath

3. In Silico Evaluation of Ibuprofen and Two Benzoylpropionic Acid Derivatives with Potential Anti-Inflammatory Activity

4. 3D-QSAR (CoMFA and CoMSIA) and pharmacophore (GALAHAD) studies on the differential inhibition of aldose reductase by flavonoid compounds

5. BLAST+: architecture and applications

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2. 2D finger-printing and molecular docking studies identified potent mosquito repellents targeting odorant binding protein 1;Insect Biochemistry and Molecular Biology;2023-06

3. The structure of AgamOBP5 in complex with the natural insect repellents Carvacrol and Thymol: Crystallographic, fluorescence and thermodynamic binding studies;International Journal of Biological Macromolecules;2023-05

4. Hierarchical Virtual Screening and Binding Free Energy Prediction of Potential Modulators of Aedes Aegypti Odorant-Binding Protein 1;Molecules;2022-10-11

5. Identification of Potential New Aedes aegypti Juvenile Hormone Inhibitors from N-Acyl Piperidine Derivatives: A Bioinformatics Approach;International Journal of Molecular Sciences;2022-09-01

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