Works by Abchir, Oussama
Results: 18
Structure-based virtual screening, ADMET analysis, and molecular dynamics simulation of Moroccan natural compounds as candidates for the SARS-CoV-2 inhibitors.
- Published in:
- Natural Product Research, 2024, v. 38, n. 24, p. 4347, doi. 10.1080/14786419.2023.2281002
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- Article
Potential Azo-8-hydroxyquinoline derivatives as multi-target lead candidates for Alzheimer's disease: An in-depth in silico study of monoamine oxidase and cholinesterase inhibitors.
- Published in:
- PLoS ONE, 2025, v. 20, n. 1, p. 1, doi. 10.1371/journal.pone.0317261
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- Article
Exploration of alpha-glucosidase inhibitors: A comprehensive in silico approach targeting a large set of triazole derivatives.
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- PLoS ONE, 2024, v. 19, n. 9, p. 1, doi. 10.1371/journal.pone.0308308
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- Article
In Silico Design of Novel Piperazine-Based mTORC1 Inhibitors Through DFT, QSAR and ADME Investigations.
- Published in:
- Biophysica, 2024, v. 4, n. 4, p. 517, doi. 10.3390/biophysica4040034
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- Article
Structure‐Based Virtual Screening, ADMET analysis, and Molecular Dynamics Simulation of Moroccan Natural Compounds as Candidates α‐Amylase Inhibitors.
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- ChemistrySelect, 2023, v. 8, n. 26, p. 1, doi. 10.1002/slct.202301092
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- Article
Design of novel benzimidazole derivatives as potential α-amylase inhibitors using QSAR, pharmacokinetics, molecular docking, and molecular dynamics simulation studies.
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- Journal of Molecular Modeling, 2022, v. 28, n. 4, p. 1, doi. 10.1007/s00894-022-05097-9
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- Article
2D‐QSAR and molecular docking studies of carbamate derivatives to discover novel potent anti‐butyrylcholinesterase agents for Alzheimer's disease treatment.
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- Bulletin of the Korean Chemical Society, 2022, v. 43, n. 2, p. 277, doi. 10.1002/bkcs.12449
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- Article
Computer-guided identification of novel inhibitors of apoptosis-signaling kinase 1 from Spondia mombim bioactive compounds against colorectal cancer.
- Published in:
- Egyptian Journal of Medical Human Genetics, 2025, v. 26, n. 1, p. 1, doi. 10.1186/s43042-024-00625-z
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- Article
ANN-QSAR, Molecular Docking, ADMET Predictions, and Molecular Dynamics Studies of Isothiazole Derivatives to Design New and Selective Inhibitors of HCV Polymerase NS5B.
- Published in:
- Pharmaceuticals (14248247), 2024, v. 17, n. 12, p. 1712, doi. 10.3390/ph17121712
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- Article
Exploring Moroccan Medicinal Plants for Anticancer Therapy Development Through In Silico Studies.
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- Pharmaceuticals (14248247), 2024, v. 17, n. 11, p. 1528, doi. 10.3390/ph17111528
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- Article
Unveiling Moroccan Nature's Arsenal: A Computational Molecular Docking, Density Functional Theory, and Molecular Dynamics Study of Natural Compounds against Drug-Resistant Fungal Infections.
- Published in:
- Pharmaceuticals (14248247), 2024, v. 17, n. 7, p. 886, doi. 10.3390/ph17070886
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- Article
An In Silico Study Based on QSAR and Molecular Docking and Molecular Dynamics Simulation for the Discovery of Novel Potent Inhibitor against AChE.
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- Pharmaceuticals (14248247), 2024, v. 17, n. 7, p. 830, doi. 10.3390/ph17070830
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- Article
Integrative Approach for Designing Novel Triazole Derivatives as α-Glucosidase Inhibitors: QSAR, Molecular Docking, ADMET, and Molecular Dynamics Investigations.
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- Pharmaceuticals (14248247), 2024, v. 17, n. 2, p. 261, doi. 10.3390/ph17020261
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- Article
Synthesis, Antimicrobial, Molecular Docking Against Bacterial and Fungal Proteins and In Silico Studies of Glucopyranoside Derivatives as Potent Antimicrobial Agents.
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- Chemistry & Biodiversity, 2024, v. 21, n. 9, p. 1, doi. 10.1002/cbdv.202400932
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- Article
In vitro and in silico analysis for elucidation of antioxidant potential of Djiboutian Avicennia Marina (Forsk.) Vierh. phytochemicals.
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- Journal of Biomolecular Structure & Dynamics, 2024, v. 42, n. 7, p. 3410, doi. 10.1080/07391102.2023.2213338
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- Article
A computer-aided drug design approach to explore novel type II inhibitors of c-Met receptor tyrosine kinase for cancer therapy: QSAR, molecular docking, ADMET and molecular dynamics simulations.
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- Journal of Biomolecular Structure & Dynamics, 2023, v. 41, n. 16, p. 7768, doi. 10.1080/07391102.2022.2124456
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- Article
Artificial Neural Network and Multiple Regression Analysis Applied to 2D-QSAR Studies: the Case of Imidazolidine-2,4-dione as PTP1B Inhibitors.
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- Philippine Journal of Science, 2024, v. 153, n. 1, p. 333, doi. 10.56899/153.01.28
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- Article
Phytochemical analysis, antimicrobial and antioxidant activities of essential oils of the species Artemisia mesatlantica maire: in vitro and in silico approaches.
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- CyTA: Journal of Food, 2024, v. 22, n. 1, p. 1, doi. 10.1080/19476337.2024.2388269
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- Article