Nucleoside‐based drug target with general antimicrobial screening and specific computational studies against SARS‐CoV‐2 main protease

SMA Kawsar, MA Hossain, S Saha… - …, 2024 - Wiley Online Library
This review article aims to significantly advance the scientific community's efforts to develop
effective nucleoside‐based drugs for treating severe acute respiratory syndrome …

An exhaustive comprehension of the role of herbal medicines in Pre-and Post-COVID manifestations

SK Prajapati, A Malaiya, G Mishra, D Jain… - Journal of …, 2022 - Elsevier
Ethnopharmacological relevance The coronavirus disease (COVID-19) has relentlessly
spread all over the world even after the advent of vaccines. It demands management …

[HTML][HTML] Green Synthesis and Antimicrobial Activities of Silver Nanoparticles Using Calotropis gigantea from Ie Seu-Um Geothermal Area, Aceh Province, Indonesia

P Kemala, R Idroes, K Khairan, M Ramli, Z Jalil… - Molecules, 2022 - mdpi.com
Herein, we report our success synthesizing silver nanoparticles (AgNPs) using aqueous
extracts from the leaves and flowers of Calotropis gigantea growing in the geothermal …

[HTML][HTML] Cheminformatics Identification of Phenolics as Modulators of Penicillin-Binding Protein 2a of Staphylococcus aureus: A Structure–Activity-Relationship-Based …

JO Aribisala, S Sabiu - Pharmaceutics, 2022 - mdpi.com
The acquisition of penicillin-binding protein (PBP) 2a in resistant strains of Staphylococcus
aureus allows for the continuous production of cell walls even after the inactivation of …

Identification of medicinal plant-based phytochemicals as a potential inhibitor for SARS-CoV-2 main protease (Mpro) using molecular docking and deep learning …

A Hossain, ME Rahman, MS Rahman… - Computers in biology …, 2023 - Elsevier
Highly transmissive and rapidly evolving Coronavirus disease-2019 (COVID-19), a viral
disease caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) …

Withania somnifera (L.) Dunal (Ashwagandha) for the possible therapeutics and clinical management of SARS-CoV-2 infection: Plant-based drug discovery and …

M Singh, K Jayant, D Singh, S Bhutani… - Frontiers in Cellular …, 2022 - frontiersin.org
Coronavirus disease 2019 (COVID-19) pandemic has killed huge populations throughout
the world and acts as a high-risk factor for elderly and young immune-suppressed patients …

Application of molecular dynamics simulation for exploring the roles of plant biomolecules in promoting environmental health

J Wu, T Gao, H Guo, L Zhao, S Lv, J Lv, R Yao… - Science of The Total …, 2023 - Elsevier
Understanding the dynamic changes of plant biomolecules is vital for exploring their
mechanisms in the environment. Molecular dynamics (MD) simulation has been widely used …

[PDF][PDF] Fatimawali

TE Tallei, SG Tumilaar, NJ Niode - Kepel, BJ, 2021 - academia.edu
Before entering the cell, the SARS-CoV-2 spike glycoprotein receptor-binding domain (RBD)
binds to the human angiotensin-converting enzyme 2 (hACE2) receptor. Hence, this RBD is …

In silico exploration of phenolics as modulators of penicillin binding protein (PBP) 2× of Streptococcus pneumoniae

JO Aribisala, NW S'thebe, S Sabiu - Scientific Reports, 2024 - nature.com
Infections caused by multidrug-resistant Streptococcus pneumoniae remain the leading
cause of pneumonia-related deaths in children< 5 years globally, and mutations in penicillin …

A computational comparative analysis of the binding mechanism of molnupiravir's active metabolite to RNA‐dependent RNA polymerase of wild‐type and Delta …

I Celik, TE Tallei - Journal of Cellular Biochemistry, 2022 - Wiley Online Library
The antiviral drug molnupiravir targets the SARS‐CoV‐2 RNA‐dependent RNA polymerase
(RdRP) enzyme. Early treatment with molnupiravir reduced the risk of hospitalization or …