Highly active P25@Pd/C nanocomposite for the degradation of Naphthol Blue Black with visible light Fulltext Access 28 Pages 2018
Alterations in apparent diffusion coefficient values of the kidney during the cardiac cycle: Evaluation with ECG-triggered diffusion-weighted MR imaging Fulltext Access 28 Pages 2018
Application of attenuated total reflectance Fourier Transform Infrared spectroscopy (ATR-FTIR) in MIR range coupled with chemometrics for detection of pig body fat in pure ghee (heat clarified milk fat) Fulltext Access 28 Pages 2018
Glutamate quantification by PRESS or MEGA-PRESS: Validation, repeatability, and concordance Fulltext Access 28 Pages 2018
Rapid B1 field mapping at 3â¯T using the 180° signal null method with extended flip angle Fulltext Access 28 Pages 2018
Preparation, characterization and binding behaviors of host-guest inclusion complexes of metoclopramide hydrochloride with α- and β-cyclodextrin molecules Fulltext Access 28 Pages 2018
Synthesis, rotational, vibrational and transitional spectra investigation on novel ethyl-4-(3-(benzo[d]1,3di-oxole-5-carboxamido)phenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxopyrimidine-5-carboxylate Fulltext Access 29 Pages 2018
Synthesis, structure, electrochemical properties and superoxide radical scavenging activities of two thiocyanate copper(II) complexes with different pyridyl-benzoxazole ligands Fulltext Access 29 Pages 2018
Synthesis, crystal structure and DFT calculations of a cyanido-bridged dinuclear zinc(II) complex of cis-1,2-diaminocyclohexane (Dach) containing a dinuclear cyanidozincate(II) anion, [Zn2(Dach)4(CN)][Zn2(CN)7]·2CH3OH Fulltext Access 29 Pages 2018
A novel pseudo-centrosymmetric POâ¯HOHâ¯OP synthon in crystal structures of azaheterocyclic phosphonates Fulltext Access 29 Pages 2018
AC/DC electrical conduction and dielectric properties of PMMA/PVAc/C60 down-shifting nanocomposite films Fulltext Access 29 Pages 2018
Theoretical aspect of the bonding in bis-chelate thiosemicarbazones nickel (II) complexes: A DFT study Fulltext Access 29 Pages 2018
Experimental and theoretical investigation of N-(4-nitrobenzoyl)-S-(cyclohexyl)-dithiocarbamate, N-(4-nitrobenzoyl)-S-benzyldithiocarbamate Fulltext Access 29 Pages 2018
Synthesis, structural exploration, spectral and combinatorial analysis of racemic-3-isobutyl-5-phenyl-5-(pyridin-4-yl)imida-zolidine-2,4-dione: Comparison between experimental and DFT calculations Fulltext Access 29 Pages 2018
Synthesis, crystal structure and DFT studies of a novel dinuclear copper(I) complex with triphenylphosphine and 2-mercaptonicotinic acid Fulltext Access 29 Pages 2018
Study on the structure, vibrational analysis and molecular docking of fluorophenyl derivatives using FT-IR and density functional theory computations Fulltext Access 29 Pages 2018
Excited state reactions of β-pyridyl-o-divinylbenzenes as a pathway to versatile polycyclic compounds with the unusual entrapment of multiple isomerized dihydro-intermediates Fulltext Access 29 Pages 2018
Unexpected formation of 1-[4-chloromethylphenyl]-5-[4-(methylsulfonyl)benzyl]-1H-tetrazole and 1-[4-chloromethylphenyl]-5-[4-(aminosulfonyl)phenyl]-1H-tetrazole: Crystal structure, bioassay screening and molecular docking studies Fulltext Access 29 Pages 2018
Green synthesis of nano sized transition metal complexes containing heterocyclic Schiff base: Structural and morphology characterization and bioactivity study Fulltext Access 29 Pages 2018
Synthesis and characterization of homoleptic group 10 dithiocarbamate complexes and heteroleptic Ni(II) complexes, and the use of the homoleptic Ni(II) for the preparation of nickel sulphide nanoparticles Fulltext Access 29 Pages 2018
Synthesis, spectral characterization and structural studies of a novel O, N, O donor semicarbazone and its binuclear copper complex with hydrogen bond stabilized lattice Fulltext Access 29 Pages 2018
Hole transfer from CdSe nanoparticles to TQ1 polymer in hybrid solar cell device Fulltext Access 29 Pages 2018
The dominant role of side chains in supramolecular double helical organisation in synthetic tripeptides Fulltext Access 29 Pages 2018
Synthesis, characterization, experimental and theoretical structure of novel Dichloro(bis{2-[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl-κN3]pyridine-κN})metal(II) compounds, metal = Mn, Co and Ni Fulltext Access 29 Pages 2018
Structure-activity relationship of the ionic cocrystal: 5-amino-2-naphthalene sulfonate·ammonium ions for pharmaceutical applications Fulltext Access 29 Pages 2018
Novel cocrystal of N-phthaloyl-β-alanine with 2,2-bipyridyl: Synthesis, computational and free radical scavenging activity studies Fulltext Access 29 Pages 2018
Pharmacophore modeling, molecular docking and molecular dynamics simulations toward identifying lead compounds for Chk1 Fulltext Access 29 Pages 2018
Analysis on molecular, spectroscopic and electronic behavior of 4,4'-(butane-1,4-diyl)bis(1-((1-(4-chlorobenzyl)-1H-1,2,3-triazol-5-yl)methyl)-3-methyl-1H-1,2,4-triazol-5(4H)-one): A theoretical approach Fulltext Access 29 Pages 2018
Understand the acquired resistance of RTK inhibitors by computational receptor tyrosine kinases network Fulltext Access 29 Pages 2018
HIF-1α represses the expression of the angiogenesis inhibitor thrombospondin-2 Fulltext Access 29 Pages 2018
Functional Prediction of Hypothetical Transcription Factors of Escherichia coli K-12 Based on Expression Data Fulltext Access 29 Pages 2018
Excited state intramolecular proton transfer induced fluorescence in triphenylamine molecule: Role of structural conformation and reversible mechanofluorochromism Fulltext Access 29 Pages 2018
Synthesis, characterization and computational studies of 3-{(E)-[(2-hydroxyphenyl)imino]methyl}benzene-1,2-diol and molecular structure of its zwitterionic form Fulltext Access 29 Pages 2018
A novel approach for accelerating mouse abdominal MRI by combining respiratory gating and compressed sensing Fulltext Access 29 Pages 2018
Pharmacophore-based virtual screening for identifying β5 subunit inhibitor of 20S proteasome Fulltext Access 30 Pages 2018
Synthesis, spectral characterization and X-ray crystal structure studies of 3-(benzo[d][1,3]dioxol-5-yl)-5-(3-methylthiophen-2-yl)-4,5-dihydro-1H-pyrazole-1-carboxamide: Hirshfeld surface, DFT and thermal analysis Fulltext Access 30 Pages 2018
Synthesis, structural studies and antimicrobial activity of N'-((2Z, 3E)-3-(hydroxyimino)butan-2-ylidene)-2-phenylacetohydrazide and its Co(II), Ni(II) complexes Fulltext Access 30 Pages 2018
Synthesis, characterization, crystal structures and DFT studies of some new 1,2,4-triazole and triazolidin derivatives Fulltext Access 30 Pages 2018
Analysis of spin-Hamiltonian and molecular orbital coefficients of Cu2+ doped C8H11KO8 single crystal through EPR technique Fulltext Access 30 Pages 2018
Empirical reproducibility, sensitivity, and optimization of acquisition protocol, for Neurite Orientation Dispersion and Density Imaging using AMICO Fulltext Access 30 Pages 2018
HMGB1-mediated DNA bending: Distinct roles in increasing p53 binding to DNA and the transactivation of p53-responsive gene promoters Fulltext Access 30 Pages 2018
Subcortical brain iron deposition and cognitive performance in older women with breast cancer receiving adjuvant chemotherapy: A pilot MRI study Fulltext Access 30 Pages 2018
A metadynamic approach to understand the recognition mechanism of the histone H3 tail with the ATRXADD domain Fulltext Access 30 Pages 2018
Layilin is critical for mediating hyaluronan 35Â kDa-induced intestinal epithelial tight junction protein ZO-1 in vitro and in vivo Fulltext Access 30 Pages 2018
La involvement in tRNA and other RNA processing events including differences among yeast and other eukaryotes Fulltext Access 30 Pages 2018
Synthesis, DFT calculations, spectroscopic and photovoltaic of the novel Nâ³, Nâ´-bis[(4,9-dimethoxy-5-oxo-5H-furo[3,2-g]chromen-6-yl)methylidene] thiocarbonohydrazide (BFCMT) and its photodiode application Fulltext Access 30 Pages 2018
Synthesis of nanocrystalline NiO/ZnO heterostructured composite powders by sol-gel auto combustion method and their characterizations Fulltext Access 30 Pages 2018
1D helical cadmium coordination polymers containing hydrazide ligand: The role of solvent and molar ratio Fulltext Access 30 Pages 2018
Fabrication of p-Si/n-ZnO:Al heterojunction diode and determination of electrical parameters Fulltext Access 30 Pages 2018
Bioinformatic Analysis Reveals Conservation of Intrinsic Disorder in the Linker Sequences of Prokaryotic Dual-family Immunophilin Chaperones Fulltext Access 30 Pages 2018
3-Methylthio-4-phenyl-5-phenylamino-1,2,4-triazole hexabromotellurate:X-ray and computational study Fulltext Access 30 Pages 2018
Crystallography, vibrational, electronic and optical analysis of 4-Bromo-2-(2,5-dichloro-phenylimino)-phenol Fulltext Access 30 Pages 2018
New cobalt (II) complexes of '3-acetyl-4-hydroxy-2H-chromene-2-one': Crystal structure and Hirshfeld surface analysis, fluorescence behaviour and antioxidant activity Fulltext Access 30 Pages 2018
Fabrication of highly efficient TiO2/C3N4 visible light driven photocatalysts with enhanced photocatalytic activity Fulltext Access 30 Pages 2018
Investigation of the conformation and hydrogen bonds in adamantylthiacalix[4]arene by IR spectroscopy and DFT Fulltext Access 30 Pages 2018
Polymorphism in diaquatetrakis(6-chloro-2-hydroxypyridine)copper(II) perchlorate: Crystallographic, solution and theoretical studies and solid phase transformations Fulltext Access 30 Pages 2018
Facile synthesis and characterization of undoped, Mn doped and Nd co-doped CuO nanoparticles for optoelectronic and magnetic applications Fulltext Access 30 Pages 2018
Mesogenic materials incorporating 4H-1,2,4-triazol-3-thiol moiety: Synthesis, characterization and liquid crystals study Fulltext Access 30 Pages 2018
Synthesis, spectroscopic characterization, single crystal X-ray structure and packing analyses of [Cu(temed)(p-nitro-cinnamate)2] and [Cu(temed)(p-methoxy-cinnamate)2] Fulltext Access 30 Pages 2018
In silico toxicity profiling of natural product compound libraries from African flora with anti-malarial and anti-HIV properties Fulltext Access 30 Pages 2018
The molecular selectivity of UNC3866 inhibitor for Polycomb CBX7 protein from molecular dynamics simulation Fulltext Access 30 Pages 2018
Spectroscopic, thermal and equilibrium characterization of U(VI) ions sorption on inulin in the presence of phosphates Fulltext Access 30 Pages 2018
Synthesis, characterization, thermal and biological evaluation of Cu (II), Co (II) and Ni (II) complexes of azo dye ligand containing sulfamethaxazole moiety Fulltext Access 30 Pages 2018
Synthesis, X-ray structural, Hirshfeld surface analysis, FTIR, MEP and NBO analysis using DFT study of a 4-chlorobenzylammonium nitrate (C7ClH9N)+(NO3)- Fulltext Access 30 Pages 2018
Pentacoordinated cloro-bis-o-iminosemiquinonato MnIII and FeIII complexes Fulltext Access 30 Pages 2018
Synthesis of a zinc(II) complex with hexadentate N4S2 donor thioether ligand: X-ray structure, DNA binding study and DFT computation Fulltext Access 30 Pages 2018
THD-Tricluster: A robust triclustering technique and its application in condition specific change analysis in HIV-1 progression data Fulltext Access 30 Pages 2018
Unraveling the mechanism of l-gulonate-3-dehydrogenase inhibition by ascorbic acid: Insights from molecular modeling Fulltext Access 31 Pages 2018
Molecular docking and 4D-QSAR studies of metastatic cancer inhibitor thiazoles Fulltext Access 31 Pages 2018
TAome analysis of type-II toxin-antitoxin system from Xenorhabdus nematophila Fulltext Access 31 Pages 2018
Synthesis, characterization, electrochemical and biological activities of mixed ligand copper(II) complexes with dimethylglyoxime and amino acids Fulltext Access 31 Pages 2018
YAP transcriptionally regulates ErbB2 to promote liver cell proliferation Fulltext Access 31 Pages 2018
Spontaneous atopic dermatitis due to immune dysregulation in mice lacking Adamts2 and 14 Fulltext Access 31 Pages 2018
CCN4/WISP1 controls cutaneous wound healing by modulating proliferation, migration and ECM expression in dermal fibroblasts via α5β1 and TNFα Fulltext Access 31 Pages 2018
Identification of novel nt-MGAM inhibitors for potential treatment of type 2 diabetes: Virtual screening, atom based 3D-QSAR model, docking analysis and ADME study Fulltext Access 31 Pages 2018
Haemostatic effects of latex from Croton sparsiflorus Morang, in vitro, in vivo, in silico approaches Fulltext Access 31 Pages 2018
Prioritization of potential drug targets against P. aeruginosa by core proteomic analysis using computational subtractive genomics and Protein-Protein interaction network Fulltext Access 31 Pages 2018
A Blockchain-Based Notarization Service for Biomedical Knowledge Retrieval Fulltext Access 31 Pages 2018
Synthesis, crystal structure, vibrational profiling, DFT studies and molecular docking of N-(4-chloro-2-{[2-(1H-indol-2-ylcarbonyl) hydrazinyl](oxo)acetyl}phenyl)acetamide.DMSO: A new antiproliferative agent Fulltext Access 31 Pages 2018
A novel synthesis of octahydropyrido[3,2-c]carbazole framework of aspidospermidine alkaloids and a combined computational, FT-IR, NMR, NBO, NLO, FMO, MEP study of the cis-4a-Ethyl-1-(2hydroxyethyl)-2,3,4,4a,5,6,7,11c-octahydro-1H-pyrido[3,2-c]carbazole Fulltext Access 31 Pages 2018
Experimental and theoretical studies of the crystal structures of bis-isoxazole-bis-methylene dinitrate (BIDN) and bis-isoxazole tetramethylene tetranitrate (BITN) by x-ray crystallography and density functional theory Fulltext Access 31 Pages 2018
The syntheses, molecular structure analyses and DFT studies on new benzil monohydrazone based Schiff bases Fulltext Access 31 Pages 2018
Experimental and DFT evaluation of the 1H and 13C NMR chemical shifts for calix[4]arenes Fulltext Access 31 Pages 2018
TGA, Hirshfeld, Raman spectroscopy and computational studies of diethylammonium hexachloroplumbate [(C2H5)2NH2]2PbCl6 Fulltext Access 31 Pages 2018
X-ray, DFT, FTIR and thermal study of the antimicrobial N-benzenesulfonyl-1H-1,2,3-benzotriazole Fulltext Access 31 Pages 2018
Crystal structure, vibrational spectra, optical and DFT studies of poly[bis(L-methionine)-κS:O cadmium (II) di-μ-thiocyanato- κ2N:S; κ2S:N] Fulltext Access 31 Pages 2018
A nanocomplex of Cu(II) with theophylline drug; synthesis, characterization, and anticancer activity against K562 cell line Fulltext Access 31 Pages 2018
Structural, SC-XRD and spectroscopic investigation of schiff base derivatives: A joint experimental and DFT investigation Fulltext Access 31 Pages 2018
Spectroscopic studies of human serum albumin exposed to Fe3O4 magnetic nanoparticles coated with sodium oleate: Secondary and tertiary structure, fibrillation, and important functional properties Fulltext Access 31 Pages 2018
Synthesis, spectral characterization, quantum chemical calculations, in-vitro antimicrobial and DNA activity studies of 2-(2â²-mercaptophenyl) benzothiazole complexes Fulltext Access 31 Pages 2018
Synthesis, crystal structure and magneto-structural studies of 2D copper(II) coordination polymer containing l-alanine amino acid Fulltext Access 31 Pages 2018
Novel acrylamide ionic liquids as anti-corrosion for X-65 steel dissolution in acid medium: Adsorption, hydrogen evolution and mechanism Fulltext Access 31 Pages 2018
The crystal structures of 1-(4-bromo-2,3,5,6-tetrafluorophenyl)-3-benzyl-methylimidazolium bromides Fulltext Access 31 Pages 2018
Synthesis, characterization and anticancer studies of bis(1-phenylpiperazine dithiocarbamato) Cu(II), Zn(II) and Pt(II) complexes: Crystal structures of 1-phenylpiperazine dithiocarbamato-S,Sâ² zinc(II) and Pt(II) Fulltext Access 31 Pages 2018