Khurshid Ayub

A comprehensive DFT study on the sensing abilities of cyclic oligothiophenes (<i>n</i>CTs)

Hasnain Sajid, Khurshid Ayub, Tariq Mahmood · New Journal of Chemistry · 2019 · 56 citations

Natural Sciences, Chemistry, Materials Science +4

Covalent Organic Framework (C6N6) as a Drug Delivery Platform for Fluorouracil to Treat Cancerous Cells: A DFT Study

Mohammed A. Alkhalifah, Muhammad Yar, Imene Bayach et al. · Materials · 2022 · 51 citations · Full text

Natural Sciences, Chemistry, Medicinal Chemistry +17

Efficient Detection of Nerve Agents through Carbon Nitride Quantum Dots: A DFT Approach

Yasair S. Al‐Faiyz, Sehrish Sarfaraz, Muhammad Yar et al. · Nanomaterials · 2023 · 45 citations · Full text

Natural Sciences, Chemistry, Materials Science +17

Interaction of imidazolium based ionic liquid electrolytes with carbon nitride electrodes in supercapacitors; a step forward for understanding electrode–electrolyte interaction

Muhammad Aetizaz, Sehrish Sarfaraz, Khurshid Ayub · Journal of Molecular Liquids · 2022 · 44 citations

Natural Sciences, Chemistry, Materials Science +16

High drug carrying efficiency of boron-doped Triazine based covalent organic framework toward anti-cancer tegafur; a theoretical perspective

Abdulrahman Allangawi, Hasnain Sajid, Khurshid Ayub et al. · Computational and Theoretical Chemistry · 2022 · 34 citations

Natural Sciences, Chemistry, Materials Science +8