In Silico Pharmacokinetics, Molecular Docking and Molecular Dynamics Simulation Studies of Nucleoside Analogs for Drug Discovery- A Mini Review
SMA Kawsar, NS Munia, S Saha… - Mini Reviews in …, 2024 - benthamdirect.com
Nucleoside analogs have been widely used as antiviral, antitumor, and antiparasitic agents
due to their ability to inhibit nucleic acid synthesis. Adenosine, cytidine, guanosine …
due to their ability to inhibit nucleic acid synthesis. Adenosine, cytidine, guanosine …
In vitro potential antiviral SARS-CoV-19-activity of natural product thymohydroquinone and dithymoquinone from Nigella sativa
ER Esharkawy, F Almalki, TB Hadda - Bioorganic Chemistry, 2022 - Elsevier
Inflammation, oxidation, and compromised immunity all increase the dangers of COVID-19,
whereas many pharmaceutical protocols may lead to increased immunity such as ingesting …
whereas many pharmaceutical protocols may lead to increased immunity such as ingesting …
[HTML][HTML] Macromolecules: Synthesis, antimicrobial, POM analysis and computational approaches of some glucoside derivatives bearing acyl moieties
Macromolecules ie, carbohydrate derivatives are crucial to biochemical and medical
research. Herein, we designed and synthesized eight methyl α-D-glucopyranoside (MGP) …
research. Herein, we designed and synthesized eight methyl α-D-glucopyranoside (MGP) …
How to face COVID-19: proposed treatments based on remdesivir and hydroxychloroquine in the presence of zinc sulfate. Docking/DFT/POM structural analysis
T Ben Hadda, M Berredjem, FA Almalki… - Journal of …, 2022 - Taylor & Francis
Remdesivir and hydroxychloroquine derivatives form two important classes of heterocyclic
compounds. They are known for their anti-malarial biological activity. This research aims to …
compounds. They are known for their anti-malarial biological activity. This research aims to …
Synthesis, antimicrobial, SAR, PASS, molecular docking, molecular dynamics and pharmacokinetics studies of 5′-O-uridine derivatives bearing acyl moieties: POM …
Because of their superior antibacterial and pharmacokinetic capabilities, many nucleoside-
based esters show potential against microorganisms, and may be used as pharmacological …
based esters show potential against microorganisms, and may be used as pharmacological …
Design, synthesis, in silico and POM studies for the identification of the pharmacophore sites of benzylidene derivatives
Due to the uneven distribution of glycosidase enzyme expression across bacteria and fungi,
glycoside derivatives of antimicrobial compounds provide prospective and promising …
glycoside derivatives of antimicrobial compounds provide prospective and promising …
[HTML][HTML] Synthesis, spectral characterization, biological, FMO, MEP, molecular docking, and molecular dynamics simulation studies of cytidine derivatives as …
Nucleoside derivatives are essential to medicinal chemistry because they provide
biologically active drugs. A 5´-O-palmitoyl derivative (2) was obtained by directly treating …
biologically active drugs. A 5´-O-palmitoyl derivative (2) was obtained by directly treating …
Synthesis, Characterization, and Biological Evaluation of Some Novel Pyrazolo[5,1-b]thiazole Derivatives as Potential Antimicrobial and Anticancer Agents
The pharmacological activities of thiazole and pyrazole moieties as antimicrobial and
anticancer agents have been thoroughly described in many literature reviews. In this study …
anticancer agents have been thoroughly described in many literature reviews. In this study …
Small Molecules with Spiro-Conjugated Cycles: Advances in Synthesis and Applications
EK Beloglazkina - International Journal of Molecular Sciences, 2023 - mdpi.com
Dear Colleagues, The purpose of this Special Issue was to attract the attention of
researchers to the features of the synthesis and physico-chemical and biological …
researchers to the features of the synthesis and physico-chemical and biological …
A pair of carbazate derivatives as novel Schiff base ligands: DFT and POM theory supported spectroscopic and biological evaluation
Schiff bases are mentioned as strongly important molecular scaffolds of industrial and
medicinal purposes. Due to wide range applications of carbazate derivatives herein …
medicinal purposes. Due to wide range applications of carbazate derivatives herein …