Antibacterial activity and molecular docking studies of a selected series of hydroxy-3-arylcoumarins

MB Pisano, A Kumar, R Medda, G Gatto, R Pal, A Fais… - Molecules, 2019 - mdpi.com
activities, we investigated a series of hydroxy-3-arylcoumarins with structural features of
flavonoids for their antibacterial activity … the best antibacterial activity against Staphylococcus …

Structural, molecular docking computational studies and in-vitro evidence for antibacterial activity of mixed ligand complexes

AZ El-Sonbati, NF Omar, MI Abou-Dobara… - Journal of Molecular …, 2021 - Elsevier
Molecular docking was used to predict the binding between 8… The molecular docking of H 2
L 1 , HL 2 and its mixed ligand … with receptors; molecular docking study was accomplished by …

Synthesis, antibacterial activities and molecular docking studies of peptide and Schiff bases as targeted antibiotics

K Cheng, QZ Zheng, Y Qian, L Shi, J Zhao… - Bioorganic & medicinal …, 2009 - Elsevier
… The inhibitory activities against Escherichia coli β-ketoacyl-acyl carrier … molecular docking
simulation also surveyed. Top 10 PSB compounds which posses both good inhibitory activity

[HTML][HTML] Synthesis, antibacterial and molecular docking studies of new benzimidazole derivatives

K Gullapelli, G Brahmeshwari, M Ravichander… - Egyptian journal of basic …, 2017 - Elsevier
… The antibacterial activity of triazinane and oxadiazinane compounds have been assessed
… good activity. The synthesised molecules were subjected to molecular docking studies with …

Synthesis, molecular docking, molecular dynamic, quantum calculation, and antibacterial activity of new Schiff base-metal complexes

HE Hashem, A Nath, A Kumer - Journal of Molecular Structure, 2022 - Elsevier
activity, computational tools were used through the Density Functional Theory (DFT), molecular
docking, molecularantibacterial activity than the metal free ligands (1-2). The highest …

Density functional theory and molecular docking investigations of the chemical and antibacterial activities for 1-(4-Hydroxyphenyl)-3-phenylprop-2-en-1-one

AM Deghady, RK Hussein, AG Alhamzani, A Mera - Molecules, 2021 - mdpi.com
… methods were used widely to analyze the biological and antibacterial activities of … the
antibacterial activities of chalcones, a molecular docking study was performed for the title molecule

Antibacterial activities and molecular docking of novel sulfone biscompound containing bioactive 1, 2, 3-triazole moiety

HRM Rashdan, IA Shehadi, MT Abdelrahman… - Molecules, 2021 - mdpi.com
… In the current study, molecular docking results showed that the … Both the docking and
experimental results show that the … make interactions that stabilize its docking in the active site of …

[HTML][HTML] Molecular docking and in vitro analysis of phytoextracts from B. serrata for antibacterial activities

R Vakayil, M Anbazhagan, G Shanmugam… - …, 2021 - ncbi.nlm.nih.gov
Molecular docking results show the binding energy of Cholan-24-oic acid, 3, 12-bis (acetyloxy)-8.6
(kcal/mol) followed by Pyrene, hexadecahydro--6.7 (kcal/mol), and 5 (1H)-Azulenone…

Chemical composition, antibacterial activity and antioxidant activity of Citrus bergamia essential oil: Molecular docking simulations

M Noshad, BA Behbahani, Z Nikfarjam - Food bioscience, 2022 - Elsevier
antibacterial activity of Citrus bergamia essential oil (BEO) were investigated, and molecular
docking … and target proteins correlated with antibacterial activity and intracellular antioxidant …

Synthesis, antibacterial activities, cytotoxicity, and molecular docking studies of Salicyledene derivatives

Y Belay, A Muller, DT Ndinteh, OA Kolawole… - Journal of Molecular …, 2023 - Elsevier
antibacterial agents [16], [17], [18]. To the best of our knowledge detailed study on the
antibacterial activity of … of their antibacterial activities, cytotoxicity, and molecular docking studies. …