192 publication(s) trouvée(s)
Article scientifique
Revisiting Activity of Some Nocodazole Analogues as a Potential Anticancer Drugs Using Molecular Docking and DFT Calculations
Although potential anticancer activities of benzimidazole-based anthelmintic drugs have been approved by preclinical and clinical studies, modes of binding interactions …
Article scientifique
Structural Basis of Potential Inhibitors Targeting SARS-CoV-2 Main Protease
The Coronavirus disease-19 (COVID-19) pandemic is still devastating the world causing significant social, economic, and political chaos. Corresponding to the …
Article scientifique
Synthesis and Characterization of Macrocyclic Chiral Tröger’s Base Phenhomazine Candidates as Anticancer Agent
1,4,7,10-Tetraoxa[10](2,8)trögerophane 5 was synthesized from its corresponding precursors. Heating of 2 with p-nitrophenoxide afforded bis(p-nitrophenyl)ether 3, which was treated with …
Article scientifique
Electrically Enhanced Transition Metal Dichalcogenides as Charge Transport Layers in Metallophthalocyanine-Based Solar Cells
Transitional metal dichalcogenides (TMDs), such as molybdenum disulfide (MoS 2 ) have found application in photovoltaic cells as a charge …
Article scientifique
Natural Clinopyroxene Reference Materials for in situ Sr Isotopic Analysis via LA-MC-ICP-MS
Clinopyroxene is a major host mineral for lithophile elements in the mantle lithosphere, and therefore, its origin is vital for …
Article scientifique
Mono-Alkylated Ligands Based on Pyrazole and Triazole Derivatives Tested Against Fusarium oxysporum f. sp. albedinis: Synthesis, Characterization, DFT, and Phytase Binding Site Identification Using Blind Docking/Virtual Screening for Potent Fophy Inhibitors
Twelve recent compounds, incorporating several heterocyclic moieties such as pyrazole, thiazole, triazole, and benzotriazole, made in excellent yield up to …
Article scientifique
A Review of the Antimalarial, Antitrypanosomal, and Antileishmanial Activities of Natural Compounds Isolated From Nigerian Flora
The West African country Nigeria features highly diverse vegetation and climatic conditions that range from rain forest bordering the Atlantic …
Article scientifique
Synthesis and Characterization of 2D Metal-Organic Frameworks for Adsorption of Carbon Dioxide and Hydrogen
The reaction of Cd(NO3)2·4H2O and Zn(NO3)2·6H2O with the bipyridyl ligand H2bpdc (2,2’-bipyridine-4,4’-dicarboxylic acid) afforded two porous metal organic frameworks [Cd(bpdc)2(DMF)2·2DMF]n …
Article scientifique
Chiral-at-Metal: Iridium(III) Tetrazole Complexes With Proton-Responsive P-OH Groups for CO2 Hydrogenation
A rise in atmospheric carbon dioxide levels, following years of burning fossil fuels, has brought about increase in global temperatures …
Article scientifique
Highly Selective Optical Sensor Eu (TTA)3 Phen Embedded in Poly Methylmethacrylate for Assessment of Total Prostate Specific Antigen Tumor Marker in Male Serum Suffering Prostate Diseases
A low-cost, simple, and highly selective method was used for the assessment of total prostate specific antigen (tPSA) in the …
Article scientifique
Novel Leu-Val Based Dipeptide as Antimicrobial and Antimalarial Agents: Synthesis and Molecular Docking
The increase of antimicrobial resistance (AMR) and antimalarial resistance are complex and severe health issues today, as many microbial strains …
Article scientifique
Experimental and Computational Approaches of Newly Polymorphic Supramolecular H-Bonded Liquid Crystal Complexes
New 1:2 liquid crystalline supramolecular H-bonded complexes (SMHBCs) were synthesized through double H-bond interactions between 4-(nicotinoyloxy) phenyl nicotinate as the …
Article scientifique
Mechanochemical Synthesis and Physicochemical Characterization of Isoniazid and Pyrazinamide Co-crystals With Glutaric Acid
The present work reports two novel pharmaceutical co-crystals INHGA and PGA in a 2:1 ratio synthesized using two first-line anti-tubercular …
Article scientifique
Supporting SARS-CoV-2 Papain-Like Protease Drug Discovery: In silico Methods and Benchmarking
The coronavirus disease 19 (COVID-19) is a rapidly growing pandemic caused by the severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2). …
Article scientifique
Comparative Analyses of Physicochemical Properties of Artisanal Refined Gasoline and Regular Automotive Gasoline
Physicochemical properties of Artisanal Refined Gasoline (ARG) and Regular Automotive Gasoline (RAG) sampled from Eastern Obolo Creek and Mkpat Enin, …
Article scientifique
Identification of a New Potential SARS-COV-2 RNA-Dependent RNA Polymerase Inhibitor via Combining Fragment-Based Drug Design, Docking, Molecular Dynamics, and MM-PBSA Calculations
Recently, the world may never experience an outbreak like the coronavirus pandemic. Infections are increasing without reaching a peak. WHO …
Article scientifique
The Cs2AgRhCl6 Halide Double Perovskite: A Dynamically Stable Lead-Free Transition-Metal Driven Semiconducting Material for Optoelectronics
A-Site doping with alkali ions, and/or metal substitution at the B and B'-sites, are among the key strategies in the …
Article scientifique
Magnetic Solid Phase Extraction Based on Nanostructured Magnetic Porous Porphyrin Organic Polymer for Simultaneous Extraction and Preconcentration of Neonicotinoid Insecticides From Surface Water
In this study, a magnetic porphyrin-based porous organic polymer (MP-POP) nanocomposite was successfully synthesized according previous studies and applied as …
Erratum
Corrigendum: Dispersion and Stabilization of Exfoliated Graphene in Ionic Liquids
Emilie Bordes 1, Bishoy Morcos 2, 3, David Bourgogne 1, Jean-Michel Andanson 1,Pierre-Olivier Bussière 1, Catherine C. Santini 2, Anass …
Article scientifique
Recent Insights Into Electronic Performance, Magnetism and Exchange Splittings in the Cr-substituted CaO
The first-principles computations of density functional theory are employed to characterize the structural properties, electronic structures and ferromagnetism induced by …