AA
ALI ALTHARAWI
Prince Sattam Bin Abdulaziz University
Research areas: Chemistry · Organic Chemistry · Synthesis and Characterization of Heterocyclic Compounds · Computational Drug Discovery Methods · Synthesis and biological activity
0000-0002-6491-6611
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Education history is unavailable.
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Publications (73)
- Exploring 1-(1,3-dioxoisoindolin-2-yl)-3-aryl urea analogues as antiproliferative agents: Solvent-free synthesis, in-vitro and in-silico studies Save
- TPA–histidine@MgCl2 DES as novel catalyst and electrolyte for the electrochemical synthesis of quinoline and isoquinoline amide derivatives and their anticancer screening Save
- Corrosion inhibition and molecular safety assessment of debo for carbon steel in hydrochloric acid: Experimental, DFT, docking, ADMET and molecular dynamics insights Save
- Efficient corrosion inhibition performance of E24 steel by a benzo[d]oxazole derivative: Insights from DFT and molecular dynamics simulations Save
- Integrative Computational Chemistry Approaches in Modern Drug Discovery: Advances in Docking, Pharmacophore Modeling, Molecular Dynamics, and Virtual Screening Save
- Synthesis and anticorrosion efficiency of a benzo[d]oxazole derivative for E24 steel: Insights from DFT and molecular dynamics simulations Save
- Boron and nitrogen-doped coronene as high-performance sensors for gamma-hydroxybutyrate drug sensing: A DFT/TD-DFT study Save
- Exosome biosensors for detection of Lung cancer Save
- GDF-15 as an integrative cardiometabolic biomarker Save
- Investigation of a Synergistic Corrosion Inhibitor for Mild Steel in Acidic Solutions: Theoretical and Experimental Analysis Save
- New catalyst for synthesis of cyclic nucleosides: Insights into silyl-Hilbert-Johnson reaction, ADME survey, dynamic simulation and molecular docking studies targeting HCV Save
- Environmental Sustainability Study for the Determination of Ketoprofen in the Presence of Its Main Photo-Degradation Products in River Water Using Solid-Contact Electrodes Save
- Pyrazolopyrimidine fused thiazolidinone hybrids as CDK2 inhibitors: insights from pharmacophore modeling, docking, DFT and molecular dynamics simulations Save
- Synthesis, characterization, DFT, and in-Silico analysis of isoxazole-thiazolidinone hybrids: Reactivity and anticancer potential assessed through pharmacological network, molecular dynamics, molecular docking, and ADMET analysis Save
- Identification of potential inhibitors of hypoxanthine-guanine phosphoribosyl transferase for cancer treatment by molecular docking, dynamics simulation and in vitro studies Save
- Drug Repurposing for the Discovery of Potential Inhibitors Targeting DJ-1 (PARK7) Against Parkinson’s Disease Save
- COVID-19 detection via isobutyric acid biomarker: A DFT computational study on beryllium-doped C60 fullerene Save
- Design, synthesis, biological evaluation, and in silico study of quinazoline-based dual inhibitors targeting EGFR and VEGFR-2 for cancer therapy Save
- Harnessing agricultural and agro-industrial waste for eco-friendly scale inhibitors: a review Save
- Novel and innovative sustainable HNFM@FeCl4 DES as an electrolyte, solvent, and catalyst for rapid electro-organic synthesis of spirooxindole and 4H-pyran derivatives with cytotoxicity assessment Save