Arama Sonuçları - "density functional theory"

Theoretical investigation of cyclooxygenase inhibition property of several non-steroidal anti-inflammatory drugs by density functional theory calculations and molecular docking studies Yazar: Atena Najdian, Amirhossein Sakhteman, Maryam Mortazavi, Hossein Sadeghpour, Massoud Amanlou

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Theoretical investigation of cyclooxygenase inhibition property of several non-steroidal anti-inflammatory drugs by density functional theory calculations and molecular docking studies Yazar: Atena Najdian, Amirhossein Sakhteman, Maryam Mortazavi, Hossein Sadeghpour, Massoud Amanlou

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A review of pollutant's interactions onto carbon nanotubes in wastewater treatment using density functional theory / Siti Umi Abd Rani and Marina Mokhtar Yazar: Abd Rani, Siti Umi, Mokhtar, Marina

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Surface engineered mesoporous silica carriers for the controlled delivery of anticancer drug 5-fluorouracil: Computational approach for the drug-carrier interactions using density functional theory Yazar: Fozia Rehman, Fozia Rehman, Asif Jamal Khan, Zaib Us Sama, Hussah M. Alobaid, Mazhar Amjad Gilani, Sher Zaman Safi, Sher Zaman Safi, Nawshad Muhammad, Abdur Rahim, Abid Ali, Jiahua Guo, Muhammad Arshad, Talha Bin Emran, Talha Bin Emran

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Benchmarking docking, density functional theory and molecular dynamics studies to assess the aldose reductase inhibitory potential of Trigonella foenum-graecum compounds for managing diabetes-associated complications Yazar: Mohammed Albratty, Neelaveni Thangavel, Balakumar Chandrasekaran, Abdulkarim M. Meraya, Hassan Ahmad Alhazmi, Sankar Muthumanickam, Pandi Boomi, Natarajan Boopala Bhagavan, Safaa F. Saleh

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Unveiling Moroccan Nature's Arsenal: A Computational Molecular Docking, Density Functional Theory, and Molecular Dynamics Study of Natural Compounds against Drug-Resistant Fungal Infections Yazar: Imane Yamari, Oussama Abchir, Hassan Nour, Meriem Khedraoui, Bouchra Rossafi, Abdelkbir Errougui, Mohammed Talbi, Abdelouahid Samadi, MHammed El Kouali, Samir Chtita

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ANALISIS PENGARUH LAPISAN rGO PADA LaFeO3 YANG DI-DOPING Gd SEBAGAI MATERIAL SENSOR GAS ETANOL MENGGUNAKAN DENSITY FUNCTIONAL THEORY Yazar: Maulana Ibrohim, -

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Carbon Nanotubes Recent Progress

Konular: “…composites, polymer, nanocomposite, density functional theory, cellulose, laser…”
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Synthesis, antioxidant activity, and density functional theory study of some novel 4-[(benzo[d]thiazol-2-ylimino)methyl]phenol derivatives: a comparative approach for the explanation of their radical scavenging activities Yazar: Mohammad hossein Asgarshamsi, Afshin Fassihi, Farshid Hassanzadeh, Lotfollah Saghaei, Ahmad Movahedian Attar, Hossein Mohammad-Beigi

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Graphene A Wonder Material for Scientists and Engineers

Konular: “…density functional theory…”
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Recent Progress in Organometallic Chemistry

Konular: “…environment, drug delivery, nanotechnology, density functional theory, electrochemistry, iron…”
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Tribology, Lubricants and Additives

Konular: “…antioxidant, biomaterials, density functional theory, cytotoxicity, oxidation, ionic liquid…”
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Drug Design Novel Advances in the Omics Field and Applications

Konular: “…bioactive compounds, drug discovery, genomics, proteomics, density functional theory, metabolites…”
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Adhesives Applications and Properties

Konular: “…nanocomposites, tissue engineering, risk assessment, density functional theory, cytotoxicity, biocompatibility…”
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Titanium Dioxide

Konular: “…photocatalysis, tio2, photocatalyst, simulation, density functional theory, photoluminescence…”
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Noble and Precious Metals Properties, Nanoscale Effects and Applications

Konular: “…cancer, nanoparticles, density functional theory, gold nanoparticles, silver, plasmonics…”
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Light-Emitting Diodes New Perspectives

Konular: “…density functional theory…”
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Chemical Reactions in Inorganic Chemistry

Konular: “…density functional theory, graphene, carbon nanotubes, arsenic, optical properties, sol-gel…”
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Density Functional Calculations Recent Progresses of Theory and Application

Konular: “…density functional theory, conceptual dft, dft calculations, nanoparticles, spectroscopy, molecular modeling…”
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Real Perspective of Fourier Transforms and Current Developments in Superconductivity

Konular: “…breast cancer, density functional theory, pattern recognition, wavelet transform, spectral analysis, numerical methods…”
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