Author

Sonam Shakya

Observed name: Shakya, Sonam

Observed institution: Aligarh Muslim University

ORCID: 0000-0002-3581-8545

Observed ORCID: 0000-0002-3581-8545

OpenAlex ID: A5086171145

Exploring Colorimetric Real-Time Sensing Behavior of a Newly Designed CT Complex toward Nitrobenzene and Co2+: Spectrophotometric, DFT/TD-DFT, and Mechanistic Insights

2019 · Ishaat M. Khan, Sonam Shakya · ACS Omega · 112

Novel thiophene Chalcones-Coumarin as acetylcholinesterase inhibitors: Design, synthesis, biological evaluation, molecular docking, ADMET prediction and molecular dynamics simulation

2021 · Aso Hameed Hasan, Sankaranarayanan Murugesan, et al. · Bioorganic Chemistry · 101

Charge transfer complexes: Emerging and promising colorimetric real-time chemosensors for hazardous materials

2020 · Sonam Shakya, Ishaat M. Khan · Journal of Hazardous Materials · 98

Charge transfer complex based real-time colorimetric chemosensor for rapid recognition of dinitrobenzene and discriminative detection of Fe2+ ions in aqueous media and human hemoglobin

2020 · Sonam Shakya, Ishaat M. Khan, et al. · Journal of Photochemistry and Photobiology A Chemistry · 89

Preparation, single-crystal investigation and spectrophotometric studies of proton transfer complex of 2,6-diaminopyridine with oxalic acid in various polar solvents

2017 · Ishaat M. Khan, Sonam Shakya, et al. · Journal of Molecular Liquids · 70

Synthesis, characterization, antimicrobial and DNA binding properties of an organic charge transfer complex obtained from pyrazole and chloranilic acid

2020 · Ishaat M. Khan, Maidul Islam, et al. · Bioorganic Chemistry · 65

Potential inhibitory activity of phytoconstituents against black fungus: In silico ADMET, molecular docking and MD simulation studies

2022 · Narmin Hamaamin Hussen, Aso Hameed Hasan, et al. · Computational Toxicology · 63

Exploring interaction dynamics of designed organic cocrystal charge transfer complex of 2-hydroxypyridine and oxalic acid with human serum albumin: Single crystal, spectrophotometric, theoretical and antimicrobial studies

2020 · Ishaat M. Khan, Sonam Shakya, et al. · Bioorganic Chemistry · 63

Synthesis, spectroscopic characterization, antimicrobial activity, molecular docking and DFT studies of proton transfer (H-bonded) complex of 8-aminoquinoline (donor) with chloranilic acid (acceptor)

2021 · Ishaat M. Khan, Maidul Islam, et al. · Journal of Biomolecular Structure and Dynamics · 56

One-pot synthesis, molecular docking, ADMET, and DFT studies of novel pyrazolines as promising SARS-CoV-2 main protease inhibitors

2022 · Rezan Huseen Hama Salih, Aso Hameed Hasan, et al. · Research on Chemical Intermediates · 52

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Synthesis and spectrophotometric studies of CT complex between 1,2-dimethylimidazole and picric acid in different polar solvents: exploring antimicrobial activities and molecular (DNA) docking

2020 · Ishaat M. Khan, Sonam Shakya, et al. · Physics and Chemistry of Liquids · 51

In silico discovery of multi-targeting inhibitors for the COVID-19 treatment by molecular docking, molecular dynamics simulation studies, and ADMET predictions

2022 · Aso Hameed Hasan, Narmin Hamaamin Hussen, et al. · Structural Chemistry · 46

Synthesis, DFT and In Silico Anti-COVID Evaluation of Novel Tetrazole Analogues

2022 · Jyothis Devasia, Sampath Chinnam, et al. · Polycyclic aromatic compounds · 45

Design, synthesis, characterizing and DFT calculations of a binary CT complex co-crystal of bioactive moieties in different polar solvents to investigate its pharmacological activity

2022 · Maidul Islam, Ishaat M. Khan, et al. · Journal of Biomolecular Structure and Dynamics · 44

Low concentrated phosphorus sorption in aqueous medium on aragonite synthesized by carbonation of seashells: Optimization, kinetics, and mechanism study

2020 · Mohd Danish Khan, Sonam Shakya, et al. · Journal of Environmental Management · 44

Multispectroscopic and Computational Analysis Insight into the Interaction of Cationic Diester-Bonded Gemini Surfactants with Serine Protease α-Chymotrypsin

2020 · Mohd. Akram, Hira Lal, et al. · ACS Omega · 43

Photocatalytic activity, DFT/ TD-DFT, and spectrophotometric studies of a synthesized charge transfer complex of p- toluidine with 1,2,4,5-benzenetetracarboxylic acid in various polar solvents

2024 · Ishaat M. Khan, Farha Naaz, et al. · Journal of Molecular Liquids · 39

Design, synthesis, anti-acetylcholinesterase evaluation and molecular modelling studies of novel coumarin-chalcone hybrids

2023 · Aso Hameed Hasan, Sonam Shakya, et al. · Journal of Biomolecular Structure and Dynamics · 38

Exploring the photocatalytic activity of synthesized hydrogen bonded charge transfer co-crystal of chloranilic acid with 2-ethylimidazole: DFT, molecular docking and spectrophotometric studies in different solvents

2022 · Ishaat M. Khan, Arshi Khan, et al. · Journal of Molecular Structure · 38

Molecular engineering of complexation between RNA and biodegradable cationic gemini surfactants: role of the hydrophobic chain length

2022 · Mohd. Akram, Hira Lal, et al. · Molecular Systems Design & Engineering · 38

Thermodynamic and structural studies of newly prepared CT complex between pyrazole as a donor and salicylic acid as acceptor at various temperatures in ethanol

2020 · Ishaat M. Khan, Kehkashan Alam, et al. · Journal of Molecular Structure · 37

Spectroscopic and Molecular Docking Studies of Cu(II), Ni(II), Co(II), and Mn(II) Complexes with Anticonvulsant Therapeutic Agent Gabapentin

2022 · Moamen S. Refat, Ahmed Gaber, et al. · Molecules · 36

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Enhancing the Antipsychotic Effect of Risperidone by Increasing Its Binding Affinity to Serotonin Receptor via Picric Acid: A Molecular Dynamics Simulation

2022 · Majid Alhomrani, Walaa F. Alsanie, et al. · Pharmaceuticals · 36

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Protective effect of the newly synthesized and characterized charge transfer (CT) complex against arecoline induced toxicity in third-instar larvae of transgenic Drosophila melanogaster (hsp70-lacZ)Bg 9 : experimental and theoretical mechanistic insights

2022 · Sonam Shakya, Ishaat M. Khan, et al. · Journal of Materials Chemistry B · 35

Supramolecular charge-transfer complex generated by the interaction between tin(II) 2,3-naphtalocyanine as a donor with DDQ as an acceptor: Spectroscopic studies in solution state and theoretical calculations

2022 · Ghaferah H. Al-Hazmi, A.M. Hassanien, et al. · Journal of Molecular Liquids · 35

Works count: 96

Citation count: 1,897

H-index: 31

I10-index: 47