Metals (Ga, In) encapsulated aluminum nitride nanotubes (AlNNTs) as nonenzymatic sensors for biomarker volatiles of liver cirrhosis: A computational study
暂无分享,去创建一个
Yasar N. Kavil | Adedapo S. Adeyinka | T. Gber | H. Louis | Faith O. Akor | Obinna C. Godfrey | Ogonna F. Ede | Abdullah G. Al-Sehemi
[1] T. Gber,et al. Molecular modeling of the structural, electronic, excited state dynamic, and the photovoltaic properties of the oligomers of n-corannulene (n = 1–4) , 2023, Heliyon.
[2] A. A. Ayi,et al. Influence of anionic species on the molecular structure, nature of bonding, reactivity, and stability of ionic liquids-based on 1-butyl-3-methylimidazolium , 2023, Journal of Molecular Liquids.
[3] Adedapo S. Adeyinka,et al. Studies on transition metals (Rh, Ir, Co) doped silicon carbide nanotubes (SiCNT) for the detection and adsorption of acrolein: Insight from DFT approach , 2023, Materials Science and Engineering: B.
[4] Fredrick C. Asogwa,et al. Electronic Structure Property and Disposal Efficiency of 2, 2- dichloropropionic acid Using Metalloid (B, Si, and Ge) Decorated Gallium nano-clusters (Ga12X12 (X=N, O)) , 2023, Journal of Computational Biophysics and Chemistry.
[5] Adedapo S. Adeyinka,et al. Yttrium- and zirconium-decorated Mg12O12–X (X = Y, Zr) nanoclusters as sensors for diazomethane (CH2N2) gas , 2023, RSC advances.
[6] O. E. Offiong,et al. Elucidation of collagen amino acid interactions with metals (B, Ni) encapsulated graphene/PEDOT material: Insight from DFT calculations and MD simulation , 2023, Journal of Molecular Liquids.
[7] Hao Liu,et al. Friction behavior of biodegradable electrospun polyester nanofibrous membranes , 2023, Tribology International.
[8] Adedapo S. Adeyinka,et al. Metals (B, Ni) encapsulation of graphene/PEDOT hybrid materials for gas sensing applications: A computational study , 2023, Talanta Open.
[9] Adedapo S. Adeyinka,et al. Modeling of Cu, Ag, and Au-decorated Al12Se12 nanostructured as sensor materials for trapping of chlorpyrifos insecticide , 2023, Computational and Theoretical Chemistry.
[10] Adedapo S. Adeyinka,et al. Functionalized boron doped graphene (BGP) as smart nanocarrier for delivery of Hydroxyurea (HU) drug , 2023, Chemical Physics Impact.
[11] Adedapo S. Adeyinka,et al. Modeling of magnesium-decorated graphene quantum dot nanostructure for trapping AsH3, PH3 and NH3 gases , 2023, RSC advances.
[12] W. Wang,et al. Unveiling the Mystery of SUMO-activating enzyme subunit 1: A Groundbreaking Biomarker in the Early Detection and Advancement of Hepatocellular Carcinoma. , 2023, Transplantation proceedings.
[13] M. Zhang,et al. Surface-Engineered Prussian Blue Nanozymes as Artificial Receptors for Universal Pattern Recognition of Metal Ions and Proteins , 2023, SSRN Electronic Journal.
[14] Chong-Zhi Wang,et al. Probiotics fortify intestinal barrier function: a systematic review and meta-analysis of randomized trials , 2023, Frontiers in Immunology.
[15] Adedapo S. Adeyinka,et al. Quantum capacitances of alkaline-earth metals: Be, Ca, and Mg integrated on Al_12N_12 and Al_12P_12 nanostructured—insight from DFT approach , 2023, Monatshefte für Chemie - Chemical Monthly.
[16] Adedapo S. Adeyinka,et al. Organochlorine detection on transition metals (X=Zn, Ti, Ni, Fe, and Cr) anchored fullerenes (C 23 X) , 2023, ChemistrySelect.
[17] W. Emori,et al. Investigation on the molecular, electronic and spectroscopic properties of rosmarinic acid: an intuition from an experimental and computational perspective , 2022, Journal of biomolecular structure & dynamics.
[18] Adedapo S. Adeyinka,et al. Heteroatoms (B, N, S) doped quantum dots as potential drug delivery system for isoniazid: insight from DFT, NCI, and QTAIM , 2022, Heliyon.
[19] G. Biskos,et al. Adsorbing CNCl on pristine, C-, and Al-doped boron nitride nanotubes: A Density Functional Theory study , 2022, Computational and Theoretical Chemistry.
[20] Jianlin Zhou,et al. The SNHG1-Centered ceRNA Network Regulates Cell Cycle and Is a Potential Prognostic Biomarker for Hepatocellular Carcinoma. , 2022, The Tohoku journal of experimental medicine.
[21] Adedapo S. Adeyinka,et al. Modeling of pristine, Ir- and Au-decorated C60 fullerenes as sensors for detection of Hydroxyurea and Nitrosourea drugs , 2022, Journal of Environmental Chemical Engineering.
[22] A. Owen,et al. Heteroatoms (Si, B, N, and P) doped 2D monolayer MoS2 for NH3 gas detection , 2022, RSC advances.
[23] Louis Hitler,et al. Computational study on the interactions of functionalized C24NC (NC = C, -OH, -NH2, –COOH, and B) with chloroethylphenylbutanoic acid , 2022, Canadian Journal of Chemistry.
[24] A. Chaudhari,et al. Bromochlorodifluoromethane interaction with pristine and doped BN nanosheets: A DFT study , 2022, Journal of Environmental Chemical Engineering.
[25] Lei Zhou,et al. Usefulness of Enzyme-Free and Enzyme-Resistant Detection of Complement Component 5 to Evaluate Acute Myocardial Infarction , 2022, Sensors and Actuators B: Chemical.
[26] I. Muz,et al. Enhanced Adsorption of Fluoroquinolone Antibiotic on the Surface of the Mg-, Ca-, Fe- and Zn-doped C60 Fullerenes: DFT and TD-DFT Approach , 2022, Materials Today Communications.
[27] Haijun Pang,et al. Rigid Schiff Base Complex Supermolecular Aggregates as a High-Performance pH Probe: Study on the Enhancement of the Aggregation-Caused Quenching (ACQ) Effect via the Substitution of Halogen Atoms , 2022, International journal of molecular sciences.
[28] Xiao-Yang Liu,et al. Sensitive and selective electrochemical determination of uric acid in urine based on ultrasmall iron oxide nanoparticles decorated urchin-like nitrogen-doped carbon. , 2022, Colloids and surfaces. B, Biointerfaces.
[29] B. Ita,et al. Spectroscopic, conformational analysis, structural benchmarking, excited state dynamics, and the photovoltaic properties of Enalapril and Lisinopril , 2022, Journal of the Indian Chemical Society.
[30] A. Chaudhari,et al. Interaction of Fluorouracil drug with boron nitride nanotube, Al doped boron nitride nanotube and BC2N nanotube , 2022, Computational and Theoretical Chemistry.
[31] Hao Li,et al. Serum Metal Ion-Induced Cross-Linking of Photoelectrochemical Peptides and Circulating Proteins for Evaluating Cardiac Ischemia/Reperfusion. , 2022, ACS sensors.
[32] Yang Wang,et al. Prognostic Factors in Stage IV Colorectal Cancer Patients With Resection of Liver and/or Pulmonary Metastases: A Population-Based Cohort Study , 2022, Frontiers in Oncology.
[33] M. Doust Mohammadi,et al. Weak intermolecular interactions of cysteine on BNNT, BNAlNT and BC2NNT: a DFT investigation , 2022, Bulletin of Materials Science.
[34] Geng Tian,et al. Evaluating Cancer-Related Biomarkers Based on Pathological Images: A Systematic Review , 2021, Frontiers in Oncology.
[35] M. Mohammadi,et al. DFT study for adsorbing of Bromine Monochloride onto BNNT (5,5), BNNT (7,0), BC2NNT (5,5), and BC2NNT (7,0) , 2021, Journal of Computational Biophysics and Chemistry.
[36] Pere Ginès,et al. Liver cirrhosis , 2021, The Lancet.
[37] M. Mohammadi,et al. Non-covalent interactions of cysteine onto C60, C59Si, and C59Ge: a DFT study , 2021, Journal of Molecular Modeling.
[38] M. Doust Mohammadi,et al. Intermolecular Interactions between Serine and C60, C59Si, and C59Ge: a DFT Study , 2021, Silicon.
[39] F. Weinhold. The Path to Natural Bond Orbitals , 2021, Israel Journal of Chemistry.
[40] Liming Cheng,et al. Deep learning-based predictive identification of neural stem cell differentiation , 2021, Nature Communications.
[41] I. Muz,et al. A first-principles evaluation on the interaction of 1,3,4-oxadiazole with pristine and B-, Al-, Ga-doped C60 fullerenes , 2021 .
[42] I. Muz,et al. Sensing capability and diameter-dependent electronic structure of boron nitride nanotubes , 2021 .
[43] I. Muz,et al. A DFT study on stability and electronic structure of AlN nanotubes , 2021 .
[44] Md. Abul Hossain,et al. Adsorption behaviour of metronidazole drug molecule on the surface of hydrogenated graphene, boron nitride and boron carbide nanosheets in gaseous and aqueous medium: A comparative DFT and QTAIM insight , 2021 .
[45] Zeyu Liu,et al. An sp-hybridized all-carboatomic ring, cyclo[18]carbon: Electronic structure, electronic spectrum, and optical nonlinearity , 2020 .
[46] I. Muz,et al. Theoretical investigation of the adsorption behaviors of fluorouracil as an anticancer drug on pristine and B-, Al-, Ga-doped C36 nanotube , 2020 .
[47] Ligong Lu,et al. SUMO1 modification of methyltransferase-like 3 promotes tumor progression via regulating Snail mRNA homeostasis in hepatocellular carcinoma , 2020, Theranostics.
[48] I. Muz,et al. A comprehensive study on electronic structure and optical properties of carbon nanotubes with doped B, Al, Ga, Si, Ge, N, P and As and different diameters , 2019, Journal of Alloys and Compounds.
[49] Wei-Quan Xie,et al. TO901317 inhibits the development of hepatocellular carcinoma by LXRα/Glut1 decreasing glycometabolism. , 2019, American journal of physiology. Gastrointestinal and liver physiology.
[50] Meihua Bao,et al. Meta-analysis of the association between MBOAT7 rs641738, TM6SF2 rs58542926 and nonalcoholic fatty liver disease susceptibility. , 2019, Clinics and research in hepatology and gastroenterology.
[51] B. Neuschwander‐Tetri,et al. Mechanisms of NAFLD development and therapeutic strategies , 2018, Nature Medicine.
[52] Zhenli Qiu,et al. Near-Infrared-to-Ultraviolet Light-Mediated Photoelectrochemical Aptasensing Platform for Cancer Biomarker Based on Core-Shell NaYF4:Yb,Tm@TiO2 Upconversion Microrods. , 2018, Analytical chemistry.
[53] S. Rayne,et al. A comparative examination of density functional performance against the ISOL24/11 isomerization energy benchmark , 2016 .
[54] J. Contreras-Garcı́a,et al. Unraveling non-covalent interactions within flexible biomolecules: from electron density topology to gas phase spectroscopy. , 2014, Physical chemistry chemical physics : PCCP.
[55] R. Viola,et al. Obesity and the gut microbiota: does up-regulating colonic fermentation protect against obesity and metabolic disease? , 2011, Genes & Nutrition.
[56] Asad Muhammad Khan,et al. Determination of Critical Micelle Concentration (Cmc) of Sodium Dodecyl Sulfate (SDS) and the Effect of Low Concentration of Pyrene on its Cmc Using ORIGIN Software , 2011 .
[57] A. Nusrat,et al. Cytokine regulation of tight junctions. , 2009, Biochimica et biophysica acta.
[58] Anna Reid,et al. Statistical Laboratories Using Minitab, SPSS and Excel: A Practical Comparison , 2002 .
[59] S. Clémendot,et al. Theoretical Study of the MoS2 (100) Surface: A Chemical Potential Analysis of Sulfur and Hydrogen Coverage. 2. Effect of the Total Pressure on Surface Stability , 2002 .
[60] M. Wilhelm,et al. Brain death and its influence on donor organ quality and outcome after transplantation. , 1999, Transplantation.
[61] S. Aizawa,et al. Reduced cell motility and enhanced focal adhesion contact formation in cells from FAK-deficient mice , 1995, Nature.
[62] W. Feuerlein,et al. [Drug addiction and drug abuse]. , 1969, Munchener medizinische Wochenschrift.
[63] B. E. Inah,et al. Hydrothermal Synthesis, crystal structure, DFT studies, and molecular docking of Zn-BTC MOF as potential antiprotozoal agents , 2022, Journal of Molecular Structure.
[64] C. Staatz,et al. Clinical Pharmacokinetics and Pharmacodynamics of Tacrolimus in Solid Organ Transplantation , 2004, Clinical pharmacokinetics.