Synthesis, biological activity and POM/DFT/docking analyses of annulated pyrano [2, 3-d] pyrimidine derivatives: Identification of antibacterial and antitumor …
Abstract New annulated pyrano [2, 3-d] pyrimidine derivatives were synthesized with
hydroxyl, methoxy, bromine, nitrile and nitro substituents on its skeleton. The correlated …
hydroxyl, methoxy, bromine, nitrile and nitro substituents on its skeleton. The correlated …
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 …
Green synthesis, antibacterial and antifungal evaluation of new thiazolidine-2, 4-dione derivatives: molecular dynamic simulation, POM study and identification of …
S Ahmed, AR Bhat, AK Rahiman… - Journal of …, 2024 - Taylor & Francis
In this study, a series of thiazolidine-2, 4-dione derivatives 3a–i were synthesized and
evaluated for antibacterial activity against Gram-positive and Gram-negative strains of …
evaluated for antibacterial activity against Gram-positive and Gram-negative strains of …
Experimental and theoretical study of polysaccharides extracted from prickly pear nopales Pulp (PPUN) of Opuntia ficus-indica as corrosion inhibitors
Corrosion causes massive damage to our equipment and buildings, wasting billions of
dollars every year. Identifying a workable answer to this problem is a priority. Scientists have …
dollars every year. Identifying a workable answer to this problem is a priority. Scientists have …
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 …
Novel N-sulfonylphthalimides: Efficient synthesis, X-ray characterization, spectral investigations, POM analyses, DFT computations and antibacterial activity
I Grib, M Berredjem, KO Rachedi, SE Djouad… - Journal of Molecular …, 2020 - Elsevier
Some novel N-sulfonylphthalimides were synthesized in good yields by condensation of
anhydride phthalic with various sulfonamides by two different methods: conventional …
anhydride phthalic with various sulfonamides by two different methods: conventional …
Sustainable and Green Corrosion Inhibition of Mild Steel: Insights from Electrochemical and Computational Approaches
Natural and fragrant compounds, essential oils (EOs) extracted from plants through
hydrodistillation, are gaining popularity as eco-friendly and sustainable agents to protect …
hydrodistillation, are gaining popularity as eco-friendly and sustainable agents to protect …
Antifungal activity of the essential oil of Pelargonium graveolens. Molecular docking, molecular dynamics, DFT, and in silico ADMET studies of five derivatives
In order to valorize Algerian aromatic and medicinal plants, this study focused on both the
evaluation of the antifungal activity of Pelargonium graveolens essential oil against the citrus …
evaluation of the antifungal activity of Pelargonium graveolens essential oil against the citrus …
Novel saccharin analogs as promising antibacterial and anticancer agents: synthesis, DFT, POM analysis, molecular docking, molecular dynamic simulations, and cell …
Saccharine is a pharmacologically significant active scaffold for various biological activities,
including antibacterial and anticancer activities. Herein, saccharinyl hydrazide (1) was …
including antibacterial and anticancer activities. Herein, saccharinyl hydrazide (1) was …
Pharmacophore study, molecular docking and molecular dynamic simulation of virgin coconut oil derivatives as anti-inflammatory agent against COX-2
KS Jack, MRB Asaruddin, SA Bhawani - Chemical and Biological …, 2022 - Springer
Background Virgin coconut oil is mostly made up of saturated fatty acids in which
approximately 72% are medium chain triglycerides. Medium chain triglycerides can be …
approximately 72% are medium chain triglycerides. Medium chain triglycerides can be …