M. Ilyas

发表

Insighting isatin derivatives as potential antiviral agents against NSP3 of COVID-19

Mohammad Y. Alshahrani, A. Al‐Sehemi, K. Ayub, 2022, Chemical Papers.

Self-assembly for hybrid biomaterial of uridine monophosphate to enhance the optical phenomena

M. Ashraf, Pengfei Wang, M. Khan, 2022, Chemical Papers.

Carbon Nanotubes: Smart Materials for the Active Elimination of Electromagnetic Interference

S. A. Shah, K. Shehzad, A. R. Khan, 2022, Iranian Journal of Science and Technology, Transactions A: Science.

A DFT approach for finding therapeutic potential of two dimensional (2D) graphitic carbon nitride (GCN) as a drug delivery carrier for curcumin to treat cardiovascular diseases

S. Muhammad, Mehvish Perveen, M. Khan, 2022, Journal of Molecular Structure.

Host-guest coupling to potentially increase the bio-accessibility of 1-(2-chloroethyl)-3-cyclohexyl-1-nitrosourea by nanocarrier graphyne for brain tumor therapy, a comprehensive quantum mechanics study.

J. Iqbal, A. A. El-Fattah, M. Zahid, 2023, Journal of molecular graphics & modelling.

Insighting the Inhibitory Potential of Novel Modafinil Drug Derivatives Against Estrogen Alpha (ERα) of Breast Cancer Through a Triple Hybrid Computational Methodology

A. Al‐Sehemi, K. Ayub, S. Muhammad, 2022, Journal of Molecular Liquids.

Insighting the Therapeutic Potential of Fifty (50) Shogaol Derivatives Against Mpro of SARS-CoV-2

S. Muhammad, Sami Ullah, Muhammad Atif, 2022, Journal of Computational Biophysics and Chemistry.

Self-Assembly of 2D Coordination Complex of Cytidine Monophosphate to Boost Up the Optical Phenomena

S Z Abbas, Z. A. Alrowaili, M. Khan, 2022, Journal of Molecular Structure.

The Electronic Properties of Cadmium Naphthalene Diimide Coordination Complex

Hui Li, M. Khan, W. Hussain, 2023, Molecules.

Controlled supramolecular interaction to enhance the bioavailability of hesperetin to targeted cancer cells through graphyne: a comprehensive in silico study

Javed Iqbal, Yanhong Zhu, M. Khan, 2022, RSC advances.

In-silico optimization of resveratrol interaction with nano-borophene: A DFT-guided study of supramolecular artistry

M. Ilyas, Shehwas Kalsoom, H. M. Zohaib, 2024, Computational Biology and Chemistry.

Exploring the Untapped Potential of Marine Sponge Compounds as Anticancer Agents against ERα of Breast Cancer

A. R. Chaudhry, A. G. Alkhathami, Afsheen Saba, 2024, Journal of Molecular Structure.