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Synthesis and DFT Quantum Chemical Calculations of 2-Oxopyrimidin-1(2H)-yl-Urea and Thiorea Derivatives

Journal of the Chemical Society of Pakistan, 2019-10, Vol.41 (5), p.841-841

2019

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Synthesis and DFT Quantum Chemical Calculations of Novel Pyrazolo[1,5-c]pyrimidin-7(1H)-one Derivatives

Journal of the Chemical Society of Pakistan, 2019-06, Vol.41 (3), p.479-479

2019

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Synthesis and DFT Studies of Pyrimidin-1(2H)-ylaminofumarate Derivatives

Journal of the Chemical Society of Pakistan, 2020-10, Vol.42 (5), p.746-746

2020

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Monitoring corrosion and corrosion control of iron in HCl by non-ionic surfactants of the TRITON-X series – Part II. Temperature effect, activation energies and thermodynamics of adsorption

Corrosion science, 2011-02, Vol.53 (2), p.540-548

2011

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Synthesis of Cyano-Benzylidene Xanthene Synthons Using a Diprotic Brønsted Acid Catalyst, and Their Application as Efficient Inhibitors of Aluminum Corrosion in Alkaline Solutions

Molecules (Basel, Switzerland), 2022-09, Vol.27 (17), p.5733

2022

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Synthesis and DFT Studies of Pyrimidin-1(2H)-ylaminofumarate Derivatives

Journal of the Chemical Society of Pakistan, 2020, Vol.42 (5), p.746-746

2020

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Corrosion behaviour of new oxo-pyrimidine derivatives on mild steel in acidic media: Experimental, surface characterization, theoretical, and Monte Carlo studies

Applied surface science advances, 2022-02, Vol.7, p.100200, Article 100200

2022

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Corrosion inhibition potential of new oxo-pyrimidine derivative on mild steel in acidic solution: Experimental and theoretical approaches

Journal of molecular structure, 2024-11, Vol.1315, p.138773, Article 138773

2024

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Corrosion inhibition of mild steel in acidic media using new oxo-pyrimidine derivatives: Experimental and theoretical insights

Journal of molecular structure, 2023-07, Vol.1284, p.135361, Article 135361

2023

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Corrosion inhibition performance of 2-ethyl phenyl-2, 5-dithiohydrazodicarbonamide on Fe (110)/Cu (111) in acidic/alkaline solutions: Synthesis, experimental, theoretical, and molecular dynamic studies

Journal of the Indian Chemical Society, 2022-09, Vol.99 (9), p.100656, Article 100656

2022

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Quantum chemical and molecular dynamics simulation studies on inhibition performances of some thiazole and thiadiazole derivatives against corrosion of iron

Journal of molecular liquids, 2016-07, Vol.219, p.497-504

2016

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Electrochemical and Corrosion Behavior of cast Re-containing Inconel 718 Alloys in Sulphuric Acid Solutions and the Effect of Cl

International journal of electrochemical science, 2014-09, Vol.9 (9), p.5352-5374

2014

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Theoretical studies of some sulphonamides as corrosion inhibitors for mild steel in acidic medium

International journal of quantum chemistry, 2010-11, Vol.110 (14), p.2614-2636

2010

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Synthesis, cytotoxic activity and quantum chemical calculations of new 7-thioxopyrazolo[1,5-f]pyrimidin-2-one derivatives

Journal of molecular structure, 2020-02, Vol.1202, p.127261, Article 127261

2020

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Adsorption behavior and corrosion inhibitive characteristics of newly synthesized cyano-benzylidene xanthenes on copper/sodium hydroxide interface: Electrochemical, X-ray photoelectron spectroscopy and theoretical studies

Journal of colloid and interface science, 2020-11, Vol.580, p.108-125

2020

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Monitoring corrosion and corrosion control of iron in HCl by non-ionic surfactants of the TRITON-X series – Part III. Immersion time effects and theoretical studies

Corrosion science, 2011-05, Vol.53 (5), p.1895-1909

2011

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Corrosion performance of electrospinning nanofiber ZnO-NiO-CuO/polycaprolactone coated on mild steel in acid solution

Surfaces and interfaces, 2020-12, Vol.21, p.100760, Article 100760

2020

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ETM and ANN study for polysubstituted 2H-pyran-2-ones

Medicinal chemistry (Shp-sariqah, United Arab Emirates), 2013-09, Vol.9 (6), p.867-874

2013

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Electrochemical, theoretical and surface physicochemical studies of the alkaline copper corrosion inhibition by newly synthesized molecular complexes of benzenediamine and tetraamine with π acceptor

Journal of molecular liquids, 2020-12, Vol.320, p.114386, Article 114386

2020

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Cathodic activation of titanium-supported gold nanoparticles: An efficient and stable electrocatalyst for the hydrogen evolution reaction

International journal of hydrogen energy, 2016-04, Vol.41 (15), p.6326-6341

2016

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Corrosion inhibition performance of 2- Fluorophenyl-2, 5-dithiohydrazodicarbonamide for copper in 3.5%NaCl Media: Experimental and Monte Carlo insights

Al-Qadisiyah journal for engineering science, 2023-09, Vol.16 (3), p.150-159

2023

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Investigation of structure-activity relationship between chemical structure and CCR5 anti HIV-1 activity in a class of 1-[N-(Methyl)-N- (phenylsulfonyl)amino]-2-(phenyl)-4-[4-(substituted)piperidin-1-yl]butane derivatives: the electronic-topological approach

Current HIV research, 2011-07, Vol.9 (5), p.300-312

2011

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Synthesis and Theoretical Study of Zinc(II) and Nickel(II)-Complexes of 5-Methoxyisatin 3-[N-(4-chlorophenyl)thiosemicarbazone]

ITB journal of science, 2012-01, Vol.44 (1), p.35-50

2012

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Quantum Chemical Studies on the Corrosion Inhibition of Fe78B13Si9 glassy alloy in Na2SO4 Solution of Some Thiosemicarbazone Derivatives

International journal of electrochemical science, 2018-08, Vol.13 (8), p.8241-8259

2018

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Quantum Chemical Investigations on Quinoline Derivatives as Effective Corrosion Inhibitors for Mild Steel in Acidic Medium

International journal of electrochemical science, 2012, Vol.7 (6), p.5643-5676

2012

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Synthesis and DFT Quantum Chemical Calculations of 2-Oxopyrimidin-1(2H)-yl-Urea and Thiorea Derivatives

Synthesis and DFT Quantum Chemical Calculations of Novel Pyrazolo[1,5-c]pyrimidin-7(1H)-one Derivatives

Synthesis and DFT Studies of Pyrimidin-1(2H)-ylaminofumarate Derivatives

Monitoring corrosion and corrosion control of iron in HCl by non-ionic surfactants of the TRITON-X series – Part II. Temperature effect, activation energies and thermodynamics of adsorption

Synthesis of Cyano-Benzylidene Xanthene Synthons Using a Diprotic Brønsted Acid Catalyst, and Their Application as Efficient Inhibitors of Aluminum Corrosion in Alkaline Solutions

Synthesis and DFT Studies of Pyrimidin-1(2H)-ylaminofumarate Derivatives

Corrosion behaviour of new oxo-pyrimidine derivatives on mild steel in acidic media: Experimental, surface characterization, theoretical, and Monte Carlo studies

Corrosion inhibition potential of new oxo-pyrimidine derivative on mild steel in acidic solution: Experimental and theoretical approaches

Corrosion inhibition of mild steel in acidic media using new oxo-pyrimidine derivatives: Experimental and theoretical insights

Corrosion inhibition performance of 2-ethyl phenyl-2, 5-dithiohydrazodicarbonamide on Fe (110)/Cu (111) in acidic/alkaline solutions: Synthesis, experimental, theoretical, and molecular dynamic studies

Quantum chemical and molecular dynamics simulation studies on inhibition performances of some thiazole and thiadiazole derivatives against corrosion of iron

Electrochemical and Corrosion Behavior of cast Re-containing Inconel 718 Alloys in Sulphuric Acid Solutions and the Effect of Cl

Theoretical studies of some sulphonamides as corrosion inhibitors for mild steel in acidic medium

Synthesis, cytotoxic activity and quantum chemical calculations of new 7-thioxopyrazolo[1,5-f]pyrimidin-2-one derivatives

Adsorption behavior and corrosion inhibitive characteristics of newly synthesized cyano-benzylidene xanthenes on copper/sodium hydroxide interface: Electrochemical, X-ray photoelectron spectroscopy and theoretical studies

Monitoring corrosion and corrosion control of iron in HCl by non-ionic surfactants of the TRITON-X series – Part III. Immersion time effects and theoretical studies

Corrosion performance of electrospinning nanofiber ZnO-NiO-CuO/polycaprolactone coated on mild steel in acid solution

ETM and ANN study for polysubstituted 2H-pyran-2-ones

Electrochemical, theoretical and surface physicochemical studies of the alkaline copper corrosion inhibition by newly synthesized molecular complexes of benzenediamine and tetraamine with π acceptor

Cathodic activation of titanium-supported gold nanoparticles: An efficient and stable electrocatalyst for the hydrogen evolution reaction

Corrosion inhibition performance of 2- Fluorophenyl-2, 5-dithiohydrazodicarbonamide for copper in 3.5%NaCl Media: Experimental and Monte Carlo insights

Investigation of structure-activity relationship between chemical structure and CCR5 anti HIV-1 activity in a class of 1-[N-(Methyl)-N- (phenylsulfonyl)amino]-2-(phenyl)-4-[4-(substituted)piperidin-1-yl]butane derivatives: the electronic-topological approach

Synthesis and Theoretical Study of Zinc(II) and Nickel(II)-Complexes of 5-Methoxyisatin 3-[N-(4-chlorophenyl)thiosemicarbazone]

Quantum Chemical Studies on the Corrosion Inhibition of Fe78B13Si9 glassy alloy in Na2SO4 Solution of Some Thiosemicarbazone Derivatives

Quantum Chemical Investigations on Quinoline Derivatives as Effective Corrosion Inhibitors for Mild Steel in Acidic Medium

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