Interaction energies between two antiandrogenic and one androgenic agonist receptor in the presence of a T877A mutation in prostate cancer: a quantum chemistry analysis

K. S. Bezerra , J. F. Vianna , J. X. Lima Neto , J. Ivan Nobre Oliveira
New Journal of Chemistry 44 ( 15) 5903 -5912

2020
Quantum biochemistry study of the T3-785 tropocollagen triple-helical structure

C.R.F. Rodrigues , J.I.N. Oliveira , U.L. Fulco , E.L. Albuquerque
Chemical Physics Letters 559 ( 559) 88 -93

22
2013
Electronic transport through oligopeptide chains: An artificial prototype of a molecular diode

J.I.N. Oliveira , E.L. Albuquerque , U.L. Fulco , P.W. Mauriz
Chemical Physics Letters 612 14 -19

6
2014
Molecular modelling and quantum biochemistry computations of a naturally occurring bioremediation enzyme: Alkane hydroxylase from Pseudomonas putida P1.

B.G. de Sousa , J.I.N. Oliveira , E.L. Albuquerque , U.L. Fulco
Journal of Molecular Graphics & Modelling 77 232 -239

4
2017
A quantum biochemistry model of the interaction between the estrogen receptor and the two antagonists used in breast cancer treatment

KB Mota , JX Lima Neto , AH Lima Costa , JIN Oliveira
Computational and Theoretical Chemistry 1089 21 -27

18
2016
Insights into solid-state properties of dopamine and L-Dopa hydrochloride crystals through DFT calculations

R.L. Araújo , J.X. Lima Neto , J.M. Henriques , R.M. Tromer
Chemical Physics Letters 761 138033

2020
Study of comparative proteome between normal and inverted karyotypes of human mesenchymal stem cells

John Lenon De Souza Santos , Alice Barros Câmara , Isabella Tanus Job e Meira , Jonas Ivan Nobre Oliveira
Acta Scientiarum. Biological Sciences 42

2020
A novel approach to identify cross-identity peptides between Epstein-Barr virus and central nervous system proteins in Guillain-Barré syndrome and multiple sclerosis

Helmut KM Patrocinio Sr , Tayna S Fiuza , Jonas Ivan N Oliveira , Joao Firmino Rodrigues-Neto
bioRxiv 2023.10. 17.562729 -2023.10. 17.562729

2023
Identification of Helicobacter Pylori-Carcinogenic TNF-alpha-Inducing Protein Inhibitors via Daidzein Derivatives through computational approaches

and Jonas Ivan Nobre Oliveira Jehad Zuhair Tayyeb , Shopnil Akash2* , Shibam Mondal3 , Md Anisur Rahman4
Journal of Cellular and Molecular Medicine ( doi.org/10.1111/jcmm.18358)

1
2024
Redundancy of Terms in Search Strategies. Comment on "Searching PubMed to Retrieve Publications on the COVID-19 Pandemic: Comparative Analysis of Search Strings".

Umberto Laino Fulco , Jonas Ivan Nobre Oliveira , Daniel Melo De Oliveira Campos
Journal of Medical Internet Research 23 ( 5)

2021
Mecanismos moleculares y epigeneticos asociados a la extinción de la memoria del miedo: una revisión sistemática

Jonas Ivan Nobre Oliveira , Stephany Esmaile Campanelli , Jaerdyson Medeiros da Rocha
eNeurobiologia 10 ( 24) 4

2019
SARS-CoV-2 virus infection: Targets and antiviral pharmacological strategies.

Daniel Melo de Oliveira Campos , Umberto Laino Fulco , Claudio Bruno Silva Oliveira , Jonas Ivan Nobre Oliveira
Journal of Evidence-based Medicine 13 ( 4) 255 -260

4
2020
In silico approach of modified melanoma peptides and their immunotherapeutic potential.

Anne Caroline Pereira , Katyanna Sales Bezerra , John Lenon Santos , Jonas Ivan Nobre Oliveira
Physical Chemistry Chemical Physics 23 ( 4) 2836 -2845

2021
Effectiveness of COVID-19 vaccines against Omicron variant

Daniel Melo de Oliveira Campos , Maria Karolaynne da Silva , Claudio Bruno Silva de Oliveira , Umberto Laino Fulco
Immunotherapy 14 ( 12) 903 -904

2
2022
Exploiting reverse vaccinology approach for the design of a multiepitope subunit vaccine against the major SARS-CoV-2 variants

Daniel Melo de Oliveira Campos , Maria Karolaynne da Silva , Emmanuel Duarte Barbosa , Chiuan Yee Leow
Computational biology and chemistry 101 107754

3
2022
In Silico Evaluation of the Binding Energies of Androgen Receptor Agonists in Wild-Type and Mutational Models

Ana Camila Campelo Albuquerque , Katyanna Sales Bezerra , Jéssica de Fátima Vianna , Sabrynna Oliveira Batista
The Journal of Physical Chemistry B 127 ( 27) 5005–5017 -5005–5017

7
2023
Deciphering Interactions between Potential Inhibitors and the Plasmodium falciparum DHODH Enzyme: A Computational Perspective

Aranthya Hevelly Lima Costa , Katyanna Sales Bezerra , José Xavier de Lima Neto , Jonas Ivan Nobre Oliveira
The Journal of Physical Chemistry B 127 9461−9475 -9461−9475

2
2023
Investigation of protein-protein interactions and hotspot region on the NSP7-NSP8 binding site in NSP12 of SARS-CoV-2

José Xavier Lima Neto , Katyanna Sales Bezerra , Emmanuel Duarte Barbosa , Roniel Lima Araujo
Frontiers in Molecular Biosciences 10 1325588 -1325588

1
2024
Computational vaccinology guided design of multi-epitope subunit vaccine against a neglected arbovirus of the Americas

Maria Karolaynne da Silva , Arthur Antunes Coimbra Azevedo , Daniel Melo de Oliveira Campos , Janeusa Trindade de Souto
Journal of Biomolecular Structure and Dynamics 41 ( 8) 3321 -3338

8
2023
Moving targets: COVID-19 vaccine efficacy against Omicron subvariants

Maria Karolaynne da Silva , Umberto Laino Fulco , Edilson Dantas da Silva Júnior , Jonas Ivan Nobre Oliveira
Molecular Therapy 30 ( 8) 2644 -2645

8
2022