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Gas phase ionization energies of some important unsaturated steroids
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Protein ligand interaction study of signal transducer smoothened protein with different drugs molecular docking and QM/MM calculations
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Structures and Photoelectron Spectra of Helium Nano Clusters
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Experimental and theoretical spectroscopic study and structural etermination of nickel(II) tridentate Schiff base complexes
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Design of novel potential aromatase inhibitors via hybrid pharmacophore approach docking improvement using the QM/MM method
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Selective complexation of alkaline earth metal ions with nanotubular cyclopeptides DFT theoretical study
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Rovibrational energy and spectroscopic constant calculations of complexes pairing via dihydrogen bonds
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تاثير زمان ماندگاري بر خواص اپتيكي نانوذرات هسته-پوسته Au/Pd ساخته شده به روش كندوسوز ليزر پالسي
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Direct Fabrication of Au/Pd(II) Colloidal Core-Shell Nanoparticles by Pulsed Laser Ablation of Gold in PdCl 2 Solution
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Ab initio intermolecular potential energy surface of Ne...NCCN van der waals complex effect of the place of midbond function on the interaction
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Immobilization of cobalt(III) Schiff base complexes onto Montmorillonite-K10 Synthesis experimental and theoretical structural determination
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Dissociation absorption and ionization of some important sulfur oxoanions (S 2 On 2- n 2 3 4 6 7 and 8)
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Photoreduction of CO2 to CO by a mononuclear Re(I) complex and DFT evaluation of the photocatalytic mechanism
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A Differential Pulse Voltammetric Sensor for Determination of Glutathione in Real Samples Using a Trichloro(terpyridine)ruthenium(III)/Multiwall Carbon Nanotubes Modified Paste Electrode
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Facile synthesis of PtePd Silicon nanostructure as an advanced electrocatalyst for direct methanol fuel cells
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Mono- and binuclear orthopalladated complexes of phosphorus ylides containing nitrogen phosphorus or bridging diphosphine ligands Self-assembly theoretical calculations and comparative catalytic activity
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Design Construction and Calibration of a Laser Ionization Time-of-Flight Mass Spectrometer
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Ab initio intermolecular potential energy surfaces for the Ar NCCN van der Waals complexes
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Effect of hydration on the stability and tautomerisms of different isomers of uracil
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DFT study on the isomerization in vitamin B6
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