Search Results - "Molecular modelling"

A Molecular Modeling Approach to Identify Novel Inhibitors of the Major Facilitator Superfamily of Efflux Pump Transporters by Sandra G. Zárate, Paula Morales, Katarzyna Świderek, Victor M. Bolanos-Garcia, Agatha Bastida

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Integrated virtual screening, molecular modeling and machine learning approaches revealed potential natural inhibitors for epilepsy by Faez Falah Alshehri

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Molecular Modeling Applied to the Discovery of New Lead Compounds for P2 Receptors Based on Natural Sources by Anael Viana Pinto Alberto, Natiele Carla da Silva Ferreira, Rafael Ferreira Soares, Luiz Anastacio Alves

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In Silico Molecular Modeling to Identify the Role of Enzymes Involved in Mitochondriogenesis Upon Malvidin-3-Glucoside Effect by Kumar Aparna Ashok

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Molecular modeling, synthesis, and antiproliferative evaluation of new isoxazole ring linked by Schiff bases and azo bond by Duha E Taha, Monther F Mahdi, Ayad M. R. Raauf

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Synthesis, Characterizations, Anti-Diabetic and Molecular Modeling Approaches of Hybrid Indole-Oxadiazole Linked Thiazolidinone Derivatives by Shoaib Khan, Tayyiaba Iqbal, Rafaqat Hussain, Yousaf Khan, Zanib Fiaz, Fazal Rahim, Hany W. Darwish

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Molecular modeling and synthesis of certain substituted aryl compounds which have a potential anticancer activity by Hosam A. Ahmed

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Molecular modeling and molecular dynamics simulation of voltage sensor domain of sodium channel in activated and resting states by Wannaruedee Wannapukdee

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New indolesulfonamide derivatives targeting the colchicine site of tubulin: synthesis, anti-tumour activity, structure-activity relationships, and molecular modelling by Alba Vicente-Blázquez, Myriam González, Manuel Medarde, Faustino Mollinedo, Rafael Peláez

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Chemical Analysis and Molecular Modelling of Cyclodextrin-Formulated Propofol and Its Sodium Salt to Improve Drug Solubility, Stability and Pharmacokinetics (Cytogenotoxicity) by Benedikt Wilhelms, Jens Broscheit, Sergey Shityakov

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Design, synthesis, anticancer evaluation, and molecular modelling studies of novel tolmetin derivatives as potential VEGFR-2 inhibitors and apoptosis inducers by Asmaa E. Kassab, Ehab M. Gedawy, Mohammed I. A. Hamed, Ahmed S. Doghish, Rasha A. Hassan

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Inclusion complexes of cefuroxime axetil with β-cyclodextrin: Physicochemical characterization, molecular modeling and effect of l-arginine on complexation by Sarika Sapte, Yogesh Pore

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Imidazopyridine-Based Thiazole Derivatives as Potential Antidiabetic Agents: Synthesis, In Vitro Bioactivity, and In Silico Molecular Modeling Approach by Rafaqat Hussain, Wajid Rehman, Shoaib Khan, Aneela Maalik, Mohamed Hefnawy, Ashwag S. Alanazi, Yousaf Khan, Liaqat Rasheed

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Targeting G-quadruplexes with Organic Dyes: Chelerythrine-DNA Binding Elucidated by Combining Molecular Modeling and Optical Spectroscopy by Alessio Terenzi, Hugo Gattuso, Angelo Spinello, Bernhard K. Keppler, Christophe Chipot, François Dehez, Giampaolo Barone, Antonio Monari

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Development of Arteannuin B Sustained-Release Microspheres for Anti-Tumor Therapy by Integrated Experimental and Molecular Modeling Approaches by Yanqing Wang, Weijuan Huang, Nannan Wang, Defang Ouyang, Lifeng Xiao, Sirui Zhang, Xiaozheng Ou, Tingsha He, Rongmin Yu, Liyan Song

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In vitro study of the effects of dihydropyrano coumarins isolated from Ferulago macrocarpa on DNA by spectroscopic and molecular modeling methods by S. Val adbeigi, M. Naderi-Moghadam*, N. Ghiasvand, F. Jafari, F. Jalilian, F. Ahmadi, S. Sajjadi, Y. Shokoohinia

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Comparison of an Addictive Potential of μ-Opioid Receptor Agonists with G Protein Bias: Behavioral and Molecular Modeling Studies by Lucja Kudla, Ryszard Bugno, Sabina Podlewska, Lukasz Szumiec, Lucja Wiktorowska, Andrzej J. Bojarski, Ryszard Przewlocki

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The Molecular Docking of Specific Reverse Transcriptase Inhibitory Ligands onto the Molecular Model of HIV-1 Reverse Transcriptase by Roohallah Yousefi

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Molecular modelling and docking analysis of katG and rpoB gene in MDR-TB isolates from North Central Indian population by Ravi Prakash, Rahul Gupta, Vishwa M. Katoch, Pramod K. Tiwari

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Synthesis, molecular modelling and QSAR study of new N-phenylacetamide-2-oxoindole benzensulfonamide conjugates as carbonic anhydrase inhibitors with antiproliferative activity by Mona F. Said, Riham F. George, Andrea Petreni, Claudiu T. Supuran, Nada M. Mohamed

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