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Discovery of Novel Transcription Factor Inhibitors Using a Pyrazole-based Small Molecule Library
A focused library of pyrazole-based compounds was constructed towards novel transcription factor inh
DFT Study for Azobenzene Crown Ether p-tert-Butylcalix[4]areneComplexed with Alkali Metal Ion
Stable molecular isomers were calculated for the azobenzene crown ether
p-tert
-butylcalix[4
Density Functional Theoretical Study on the Proton Migration in Radical Cations of Substituted Cytosine:Guanine Pair
No Abstract
Density Functional Study on the Reductive Elimination at an (NCN)Pt(IV) Center
No Abstract
DFT Studies of Band Gaps of the Fused Thiophene Oligomers
No Abstract
Doped Sol-gel TiO2 Films for Biological Applications
Mono and multilayer TiO
2
(Fe, PEG
600
) films were deposited by the dip-coating o
Determination of Parathion Metabolite, p-Nitrophenolin Urine of Parathion Factory Workers
Parathion is an organophosphate pesticide being legally applied for the purpose of agriculture and i
Docking and Virtual Screening Studies for New Leads of Boar Salivary Lipocalin
We have performed FlexX docking experiments to predict the best docking poses of 5-androst-16-en-3-o
Dicopper(II) and Dicadmium(II) Complexes of Double-Tweezer Ligand with Thiopyridine Moiety
No Abstract
Determination of a Minimum Detectable Activity through a Measurement of Pu Isotopes in Environmental Samples
In this paper, several parameters affecting the sensitivity and determining the minimum detectable a
Determination of Toxic Elements in Polymer Materials Using Instrumental Neutron Activation Analysis
Polymer materials are very difficult to decompose for the purpose of chemical analysis. Nondestructi
DFT Study for Cage-annulated p-tert-Butylcalix[4]crown-etherComplexed with Potassium Ion
Using
DFT
B3LYP/6-31+G(d,p)//B3LYP/6-31G(d,p) calculation method, stable molecular structur
Diffusion of Probe Molecule in Small Liquid n-Alkanes: A Molecular Dynamics Simulation Study
The probe diffusion and friction constants of methyl yellow (MY) in liquid n-alkanes of increasing c
Direct Stacking of Non-metallic Planar Porphyrin to DNA
Porphyrins generally bind DNA in two different ways with respect to the mixing ratio; monomeric bind
Docking and Quantum Mechanics-Guided CoMFA Analysis of b-RAF Inhibitors
Pyrazine derivatives bind to b-RAF receptor which is important in cancer therapy. The ligand-recepto
Docking Study of Biflavonoids, Allosteric Inhibitors of Protein Tyrosine Phosphatase 1B
Protein tyrosine phosphatase (PTP) 1B is the superfamily of PTPs and a negative regulator of multipl
Discovery and Synthesis of Novel N-Cyanopyrazolidine and N-Cyanohexahydropyridazine Derivatives as Cathepsin Inhibitors
The design, synthesis, and biological evaluation of structurally novel
N
-cyanopyrazolidine an
Diels-Alder Cycloaddition of Cyclopentadiene with Ethylacrylate Catalyzed by Mesoporous Al-MCM-48 and Al-MCM-41 Catalysts
In the present work, Diels-Alder reaction of cyclopentadiene with ethylacrylate has been carried out
Density Functional Study on the C-H Bond Cleavage of Aldimine by a Rhodium(I) Catalyst
We investigated the C-H bond activation mechanism of aldimine by the [RhCl(PPH
3
)
3
DFT Conformational Study of Calix[5]arene and Calix[4]arene: Hydrogen Bond
We have performed DFT calculations to investigate the conformational characteristics and hydrogen bo
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COMPARISON OF MECHANICAL PROPERTIES AND STRUCTURAL CHANGES OF CONTINUOUS BASALT AND GLASS FIBRES AT ELEVATED TEMPERATURES
Water-induced and Co-filling kontrol inducedferromagnetism in Rb2Ni3S4
Microstructure Evolution and Electrical Properties of Ba2NaNb5O15 and BaTiO3 Composites
EFFECTIVE ELASTIC PROPERTIES OF ALUMINA-ZIRCONIA COMPOSITECERAMICS - PART 4. TENSILE MODULUS OF POROUS ALUMINA AND ZIRCONIA
EFFECTIVE ELASTIC PROPERTIES OF ALUMINA-ZIRCONIA COMPOSITECERAMICS - PART 1. RATIONAL CONTINUUM THEORY OF LINEAR ELASTICITY
Q-SPECIES IN ALKALI-DISILICATE GLASSES
CRYSTALLIZATION CHARACTERISTICS OF ALKALI-IRON GERMANATECONTAINING SILICATE GLASSES
INFLUENCE OF ZIRCONIA CeO2 LATTICE STABILIZINGAGENT ON BIOGLAZE COATING
THE INFLUENCE OF SIMULATED BODY FLUID COMPOSITION ONCARBONATED HYDROXYAPATITE FORMATION
PREDICTION OF HEAT CAPACITIES OF SOLID BINARY OXIDES FROMGROUP CONTRIBUTION METHOD
SPINEL CRYSTAL DISTRIBUTION AND SETTLING IN A HIGH-LEVELWASTE MELTER WORKING AS A PERFECT MIXER
NATURAL CORROSION OF OLD POTASH GLASS COLOURED WITHURANIUM COMPOUNDS
STABILIZING THE HIGH-TEMPERATURE PROPERTIES OF GYPSUM-FREEPORTLAND CEMENT BY Al2O3 ADDITIONS
MICROSTRUCTURAL EFFECTS ON THE LUMINESCENCE INTENSITY OFPr3+-doped CaTiO3
ELECTRICAL AND DIELECTRIC PROPERTIES OF TeO2 -ZnO GLASSES
KINETICS OF HYDRATION OF MAGNESIUM OXIDE IN AQUEOUS SUSPENSION, PART 1 - METHOD OF MEASUREMENT AND EVALUATION OF EXPERIMENTAL DATA
MODEL OF ELECTRIC CONDUCTIVITY OF THICK-FILM RESISTORS, PART 4 - VOLTAGE DEPENDENCE OF RESISTIVITY
WETNESS EFFECT ON EPR Cu(II) SPIN LABEL IN HEAT TREATED SILICA XEROGELS
UNSTEADY NUMERICAL SIMULATION OF CIRCULATION AND HEAT TRANSFER IN A GLASS MELTING TANK
ZIRCONIA BASED ORGANIC PRECURSOR INFILTRATION AS A METHOD FOR PREPARATION OF ZTA CERAMICS, PART 1 - INFILTRATION
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