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Preliminary Insight of Pyrrolylated-Chalcones as New Anti-Methicillin-Resistant Staphylococcus aureus (Anti-MRSA) Agents

Molecules (Basel, Switzerland), 2021-09, Vol.26 (17), p.5314

2021

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First-principles investigation of dimethyl-functionalized MIL-53(Al) metal–organic framework for adsorption and separation of xylene isomers

Journal of porous materials, 2021-04, Vol.28 (2), p.579-591

2021

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One-pot two-component synthesis of halogenated xanthone, 3-o substituted xanthone, and prenylated xanthone derivatives as aromatase inhibitors

Results in Chemistry, 2023-01, Vol.5, p.100789, Article 100789

2023

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Anion containing novel porous Manganese-1,2,4-triazolate frameworks as battery-type electrode materials for supercapattery devices

Polyhedron, 2024-05, Vol.253, Article 116890

2024

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Effects of anthocyanidins on the conformational transition of Aβ(1-42) peptide: Insights from molecular docking and molecular dynamics simulations

Journal of molecular graphics & modelling, 2024-06, Vol.129, p.108732-108732, Article 108732

2024

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Evaluating the potential of NUIG2 metal–organic framework for adsorption of short linear alkanes at low pressure

Journal of porous materials, 2024-02, Vol.31 (1), p.391-402

2024

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Inhibitory evaluation of Curculigo latifolia on α-glucosidase, DPP (IV) and in vitro studies in antidiabetic with molecular docking relevance to type 2 diabetes mellitus

Journal of enzyme inhibition and medicinal chemistry, 2021-01, Vol.36 (1), p.109-121

2021

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Calcium l-Malate and d-Tartarate Frameworks as Adjuvants for the Sustainable Delivery of a Fungicide

ACS applied materials & interfaces, 2023-12

2023

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Identification of Dipeptidyl Peptidase-4 and α-Amylase Inhibitors from Melicope glabra (Blume) T. G. Hartley (Rutaceae) Using Liquid Chromatography Tandem Mass Spectrometry, In Vitro and In Silico Methods

Molecules (Basel, Switzerland), 2020-12, Vol.26 (1), p.1

2020

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In vitro cytotoxicity assay, mushroom tyrosinase inhibitory activity and release analysis of kojic monooleate nanodelivery system and in silico molecular docking study against 2Y9X target enzyme

Journal of drug delivery science and technology, 2021-12, Vol.66, p.102764, Article 102764

2021

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Elucidating the Aromatic Properties of Covalent Organic Frameworks Surface for Enhanced Polar Solvent Adsorption

Polymers, 2021-06, Vol.13 (11), p.1861

2021

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Development of diarylpentadienone analogues as alpha-glucosidase inhibitor: Synthesis, in vitro biological and in vivo toxicity evaluations, and molecular docking analysis

Bioorganic chemistry, 2020-11, Vol.104, p.104277, Article 104277

2020

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α-Amylase and dipeptidyl peptidase-4 (DPP-4) inhibitory effects of Melicope latifolia bark extracts and identification of bioactive constituents using in vitro and in silico approaches

Pharmaceutical biology, 2021-01, Vol.59 (1), p.962-971

2021

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Influence of anion–water interactions on the behaviour of lipases in room temperature ionic liquids

RSC advances, 2014-01, Vol.4 (89), p.48202-48211

2014

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Bioinspired mp20 mimicking uricase in ZIF-8: Metal ion dependent for controllable activity

Enzyme and microbial technology, 2024-08, Vol.178, p.110439-110439, Article 110439

2024

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One-pot solvothermal synthesis of Zr-based MOFs with enhanced adsorption capacity for Cu2+ ions removal

Journal of solid state chemistry, 2022-11, Vol.315, p.123429, Article 123429

2022

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Rational design of different π-bridges and their theoretical impact on indolo[3,2,1-jk]carbazole based dye-sensitized solar cells

Computational and theoretical chemistry, 2022-06, Vol.1212, p.113725, Article 113725

2022

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Aggregation of Polysorbate 80 in room temperature ionic liquids investigated by molecular dynamics simulations

Separation and purification technology, 2018-05, Vol.196, p.224-228

2018

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Solvation free energies in [bmim]-based ionic liquids: Anion effect toward solvation of amino acid side chain analogues

Chemical physics letters, 2014-11, Vol.615 (C), p.69-74

2014

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Antioxidant Activity of Lawsone and Prediction of its Activation Property on Superoxide Dismutase

International journal of pharmacology, 2022-05, Vol.18 (5), p.1058-1070

2022

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Reticular Chemistry and Applications: Metal-Organic Frameworks

1, 2023

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Formulating Palm-based Nanoemulsion in Room Temperature Ionic Liquids

Journal of Engineering and Applied Sciences, 2019-11, Vol.14 (18), p.6610-6619

2019

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Theoretical investigation on insulin dimer-β-cyclodextrin interactions using docking and molecular dynamics simulation

Journal of inclusion phenomena and macrocyclic chemistry, 2016-02, Vol.84 (1-2), p.1-10

2016

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Insights into host-drug interactions in metal-organic frameworks

Reticular Chemistry and Applications, 2023, p.339-370

2023

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Molecular dynamics simulation of oleyl oleate swollen micelles system

Molecular simulation, 2010-04, Vol.36 (5), p.403-407

2010

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Preliminary Insight of Pyrrolylated-Chalcones as New Anti-Methicillin-Resistant Staphylococcus aureus (Anti-MRSA) Agents

First-principles investigation of dimethyl-functionalized MIL-53(Al) metal–organic framework for adsorption and separation of xylene isomers

One-pot two-component synthesis of halogenated xanthone, 3-o substituted xanthone, and prenylated xanthone derivatives as aromatase inhibitors

Anion containing novel porous Manganese-1,2,4-triazolate frameworks as battery-type electrode materials for supercapattery devices

Effects of anthocyanidins on the conformational transition of Aβ(1-42) peptide: Insights from molecular docking and molecular dynamics simulations

Evaluating the potential of NUIG2 metal–organic framework for adsorption of short linear alkanes at low pressure

Inhibitory evaluation of Curculigo latifolia on α-glucosidase, DPP (IV) and in vitro studies in antidiabetic with molecular docking relevance to type 2 diabetes mellitus

Calcium l-Malate and d-Tartarate Frameworks as Adjuvants for the Sustainable Delivery of a Fungicide

Identification of Dipeptidyl Peptidase-4 and α-Amylase Inhibitors from Melicope glabra (Blume) T. G. Hartley (Rutaceae) Using Liquid Chromatography Tandem Mass Spectrometry, In Vitro and In Silico Methods

In vitro cytotoxicity assay, mushroom tyrosinase inhibitory activity and release analysis of kojic monooleate nanodelivery system and in silico molecular docking study against 2Y9X target enzyme

Elucidating the Aromatic Properties of Covalent Organic Frameworks Surface for Enhanced Polar Solvent Adsorption

Development of diarylpentadienone analogues as alpha-glucosidase inhibitor: Synthesis, in vitro biological and in vivo toxicity evaluations, and molecular docking analysis

α-Amylase and dipeptidyl peptidase-4 (DPP-4) inhibitory effects of Melicope latifolia bark extracts and identification of bioactive constituents using in vitro and in silico approaches

Influence of anion–water interactions on the behaviour of lipases in room temperature ionic liquids

Bioinspired mp20 mimicking uricase in ZIF-8: Metal ion dependent for controllable activity

One-pot solvothermal synthesis of Zr-based MOFs with enhanced adsorption capacity for Cu2+ ions removal

Rational design of different π-bridges and their theoretical impact on indolo[3,2,1-jk]carbazole based dye-sensitized solar cells

Aggregation of Polysorbate 80 in room temperature ionic liquids investigated by molecular dynamics simulations

Solvation free energies in [bmim]-based ionic liquids: Anion effect toward solvation of amino acid side chain analogues

Antioxidant Activity of Lawsone and Prediction of its Activation Property on Superoxide Dismutase

Reticular Chemistry and Applications: Metal-Organic Frameworks

Formulating Palm-based Nanoemulsion in Room Temperature Ionic Liquids

Theoretical investigation on insulin dimer-β-cyclodextrin interactions using docking and molecular dynamics simulation

Insights into host-drug interactions in metal-organic frameworks

Molecular dynamics simulation of oleyl oleate swollen micelles system

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