A comparative molecular dynamics study on BACE1 and BACE2 flap flexibility

H. M. Kumalo , Mahmoud E. Soliman
Journal of Receptors and Signal Transduction 36 ( 5) 505 -514

13
2016
In Vitro Antibacterial Activity of Teixobactin Derivatives on Clinically Relevant Bacterial Isolates.

E. J. Ramchuran , A. Somboro , S. A. Monaim , D. G. Amoako
Frontiers in Microbiology 9 1535

14
2018
Understanding the Binding Mechanism of Antagonist (AZD3293) Against BACE-1: Molecular Insights into Alzheimer’s Drug Discovery

Sphelele Sosibo , Daniel Gyamfi Amoako , Anou Moise Somboro , Darren Delai Sun
Letters in Drug Design & Discovery 17 ( 7) 850 -857

2020
Mechanism of Inhibition of Hsp90 Dimerization by Gyrase B Inhibitor Coumermycin A1 (C–A1) Revealed by Molecular Dynamics Simulations and Thermodynamic Calculations

Favourite N. Cele , Hezekiel Kumalo , Mahmoud E. S. Soliman
Cell Biochemistry and Biophysics 74 ( 3) 353 -363

4
2016
Theory and Applications of Covalent Docking in Drug Discovery: Merits and Pitfalls

Hezekiel Kumalo , Soumendranath Bhakat , Mahmoud Soliman
Molecules 20 ( 2) 1984 -2000

77
2015
Susceptibility of Anopheles Mosquito to Agricultural Insecticides in the Adansi North District, Ghana

Nicholas Egyir , Bernard Lawson , Kwame Desewu , Rosemary Ampofo-Bekoe
Journal of Pure and Applied Microbiology 13 ( 2) 677 -688

2019
“Mango in all her majesty”—the potential of mangiferin and its analogues in the inhibition of Eimeria tenella hexokinase—a computational approach

Kehinde F Paul-Odeniran , Paul O Odeniran , Isaiah O Ademola , Hezekiel Kumalo
Journal of Biomolecular Structure and Dynamics 41 ( 11) 5291 -5304

2023
7
2019
Toxicogenicity and mechanistic pathways of aflatoxin B1 induced renal injury.

Anou M Somboro , Daniel G Amoako , Rene B Khan , Hezekiel M Khumalo
Environmental Toxicology

4
2021
Molecular mechanisms underlying Warburgia salutaris effects on oxidative stress and apoptotic parameters in Human Hepatoma Cells

Lebogang N Maruma , Anou M Somboro , Daniel G Amoako , Hezekiel M Khumalo
bioRxiv 2022.03. 05.483129 -2022.03. 05.483129

2022
The toxicogenic effect of Terminalia phanerophlebia Engl. & Diels leaf extract on oxidative stress parameters in an in vitro Hek293 model

Marcilyn R Nyahada , Daniel G Amoako , Anou M Somboro , Isaiah Arhin
Journal of Pharmacy & Pharmacognosy Research 9 ( 3) 261 -271

2021
Mechanistic Insights into Oxidative Stress and Apoptosis Mediated by Tannic Acid in Human Liver Hepatocellular Carcinoma Cells

Priscilla Mhlanga , Pearl O Perumal , Anou M Somboro , Daniel G Amoako
International Journal of Molecular Sciences 20 ( 24) 6145

5
2019
Cytoproliferative and Anti-Oxidant Effects Induced by Tannic Acid in Human Embryonic Kidney (Hek-293) Cells

Pearl O Perumal , Priscilla Mhlanga , Anou M Somboro , Daniel G Amoako
Biomolecules 9 ( 12) 767

5
2019
Di-2-picolylamine triggers caspase-independent apoptosis by inducing oxidative stress in human liver hepatocellular carcinoma cells.

Thobeka Madide , Anou M Somboro , Daniel G Amoako , Hezekiel M Khumalo
Biotechnology and Applied Biochemistry 68 ( 2) 257 -266

2
2021
A molecular dynamics perspective into estrogen receptor inhibition by selective flavonoids as alternative therapeutic options

Angela Sinyani , Kehinde Idowu , Letitia Shunmugam , Hezekiel Mathambo Kumalo
Journal of Biomolecular Structure and Dynamics 41 ( 9) 4093 -4105

10
2023
Adsorption and Potential Covalent Immobilisation of Peptides Onto Mica Substrates

Hezekiel Mathambo Kumalo
University of KwaZulu-Natal, Durban

2013
Mechanistic Insights into Targeting SARS-CoV-2 Papain-Like Protease in the Evolution and Management of COVID-19: A Comprehensive Review

NONJABULO N MAGWAZA , AGANZE MUSHEBENGE , SAMUEL CHIMA UGBAJA , NONKULULEKO AVRIL MBATHA
Preprints

2023
Influenza Viruses: Harnessing the Crucial Role of the M2 Ion-Channel and Neuraminidase toward Inhibitor Design

Hezekiel M Kumalo , Anou M Somboro , Monsurat M Lawal , Daniel G Amoako
Molecules 26 ( 4) 880

2021
In silico Design and Synthesis of Tetrahydropyrimidinones and Tetrahydropyrimidinethiones as Potential Thymidylate Kinase Inhibitors Exerting Anti-TB Activity Against Mycobacterium tuberculosis.

Katharigatta N Venugopala , Christophe Tratrat , Melendhran Pillay , Sandeep Chandrashekharappa
Drug Design Development and Therapy 14 1027 -1039

11
2020