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Open access

Research article

First published 2021-1

A new approach to compute atomic electrophilicity index in terms of Gordy’s electronegativity

Poonam Yadav, Hiteshi Tandon, Babita Malik [...]

Journal of Chemical Research

Free access

Research article

First published 2018-11

Methoxy and Hydroxy Triphenylamine-Based Azo Dyes: Synthesis and Photophysical Properties on Polyester and Nylon Fabrics

Archana Bhagwat, Shantaram Kothavale, Suvidha Shinde [...]

AATCC Journal of Research

Free access

Research article

First published 2014-3

Predicting Reactivities of Phenyl N -methylcarbamates in their Alkaline Hydrolysis

Latifa Latrous El Atrache, Khaled Essalah, Néjib Ben Hamida

Progress in Reaction Kinetics and Mechanism

Open access

Research article

First published 2018-2

MC19 (M = B,Si,Al and Ga) fullerenes: Adsorption mechanisms of 1,4-diformylpiperazine

Özgür Alver, Cemal Parlak, Ponnadurai Ramasami

Adsorption Science & Technology

Retricted access

Research article

First published 2018-09

Investigation of the Nrf2 Stress Response at Cellular Level to Detect Compounds Inducing Oxidative and Electrophilic Stress

Helga H.J. Gerets, Karen Tilmant, Jean-Pierre Valentin [...]

Applied In Vitro Toxicology

Open access

Research article

First published 2023

Investigation of Methyl-5-(pentan-3-yloxy)-7-oxabicyclo[4.1.0]hept-3-ene-3-carboxyhydrazide Derivatives as Potential Inhibitors of COVID-19 Main Protease: DFT and Molecular Docking Study

Olawale Folorunso Akinyele, Emmanuel Gabriel Fakola, Omolara Olubunmi Adeboye [...]

Bioinformatics and Biology Insights

Open access

Research article

First published 2024

Neomangiferin,a Naturally Occurring Mangiferin Congener,Inhibits Sodium-Glucose Co-transporter-2: An In silico Approach

Ayobami J Olusola, Samson O Famuyiwa, Kolade O Faloye [...]

Bioinformatics and Biology Insights

Retricted access

Research article

First published 2018-2

DFT study of new biologically important oxidovanadium (IV) complexes of nitro-substituted benzohydroxamate ligands

Abhishek Kumar, Manjula Sharma, Bhanu Priya [...]

Journal of Computational Methods in Sciences and Engineering

Retricted access

Research article

First published 2020-2

Molecular structures and calculations of reactivity descriptors of new di-organotin (IV) phenoxyacetohydroxamate complexes: Insights from density functional theory

Vineet Kumar Choudhary, Sachin Bhardwaj, Arvind Kumar Bhatt [...]

Journal of Computational Methods in Sciences and Engineering

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