عنوان البحث | اسم المجلة | موضوع البحث | سنة النشر | DOI | الرابط الالكتروني |
Computational analysis of bevacizumab binding with protein receptors for its potential anticancer activity | Journal of biomolecular structure and dynamics | Computational chemistry | 2024 | |
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A new approach for determination of urinary 8-hydroxy-20-deoxyguanosine in cancer patients using reinforced solid/liquid phase microextraction combined with HPLC-DAD | Acta Chromatographica | Cancer biomarker analysis | 2023 | |
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Isoform switching leads to downregulation of cytokine producing genes in estrogen receptor positive breast cancer | Front. Genet., 13 October 2023 Sec. Computational Genomics | Biology Chemistry | 2023 | |
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A study of drug candidates derived from pleconaril for inhibiting coxsackievirus B3 (Cvb3) by ADMET, molecular docking, molecular dynamics and retrosynthesis | New journal of Chemistry | NJC (New Journal of Chemistry) is a broad-based primary journal encompassing all branches of chemistry and its sub-disciplines. It contains full research articles, communications, perspectives and focus articles. This well-established journal, owned by the Centre National de la Recherche Scientifique (CNRS) of France, has been co-published with the Royal Society of Chemistry since January 1998. NJC is the forum for the publication of high-quality, original and significant work that opens new d | 2022 | |
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Computational study of quinoline-based | new journal of chemistry | computational chemistry | 2022 | |
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In silico detection of potential inhibitors from vitamins and their derivatives compounds against SARS-CoV-2 main protease by using molecular docking, molecular dynamic simulation and ADMET profiling | journal of molecular structure | The Journal of Molecular Structure is dedicated to the publication of full-length articles and review papers, providing important new structural information on all types of chemical species including: | 2022 | |
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Camphor, Artemisinin and Sumac Phytochemicals as inhibitors against COVID-19: Computational approach | Computers in Biology and Medicine | Computers in Biology and Medicine, a companion title to Informatics in Medicine Unlocked, is a medium of international communication of the revolutionary advances being made in the application of the computer to the fields of bioscience and medicine. The Journal encourages the exchange of important research, instruction, ideas and information on all aspects of the rapidly expanding area of computer usage in these fields. The Journal will focus on such areas as (1) Analysis of Biomedical Systems: | 2021 | |
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Molecular dynamics simulation of a cucurbituril based molecular switch triggered by pH changes | Computational and Theoretical Chemistry | Computational Chemistry | 2015 | |
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Free energy perturbation and MM/PBSA studies on inclusion complexes of some structurally related compounds with ?-cyclodextrin | Supramolecular Chemistry | Computational Chemistry | 2009 | |
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molecular dynamics simulations and MM-PBSA calculations of the cyclodextrin inclusion complexes with 1-alkanols, para-substituted phenols and substituted imidazoles | Journal of Molecular Structure: THEOCHEM | Computational Chemistry | 2008 | |
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