H. M. Rehman

发表

A Putative Prophylactic Solution for COVID-19: Development of Novel Multiepitope Vaccine Candidate against SARS-COV-2 by Comprehensive Immunoinformatic and Molecular Modelling Approach

M. U. Mirza, M. Froeyen, Sarfraz Ahmad, 2020, Biology.

Novel Disease-Associated Missense Single-Nucleotide Polymorphisms Variants Predication by Algorithms Tools and Molecular Dynamics Simulation of Human TCIRG1 Gene Causing Congenital Neutropenia and Osteopetrosis

I. Tuzankina, K. Shinwari, Guojun Liu, 2022, Frontiers in Molecular Biosciences.

A Putative Prophylactic Solution for COVID-19: Development of Novel Multiepitope Vaccine Candidate against SARS-COV-2 by Comprehensive Immunoinformatic and Molecular Modelling Approach

M. U. Mirza, M. Froeyen, Sarfraz Ahmad, 2020, Biology.

Identification of NEK7 inhibitors: structure based virtual screening, molecular docking, density functional theory calculations and molecular dynamics simulations

K. H. Mahmoud, Z. Alrowaili, Farhan Siddique, 2022, Journal of biomolecular structure & dynamics.

Molecular Cloning, Expression, Sequence Characterization and Structural Insight of Bubalus bubalis Growth Hormone-Receptor

M. Saleem, Roquyya Gul, H. M. Rehman, 2022, Molecular Biotechnology.

Synthesis of 1,2,3-benzotriazin-4(3H)-one derivatives as α-glucosidase inhibitor and their in-silico study

Hafiz Adnan Ahmad, Matloob Ahmad, M. Ashraf, 2022, Medicinal Chemistry Research.

Green Efficient Synthesis of Urease and Acetylcholinesterase Inhibiting Anisaldehyde Derivatives and Their In-Silico Studies

D. Ahmed, H. M. Rehman, Samra Ihsan, 2022, Journal of Molecular Structure.

In Vitro Antidiabetic, Anti-Obesity and Antioxidant Analysis of Ocimum basilicum Aerial Biomass and in Silico Molecular Docking Simulations with Alpha-Amylase and Lipase Enzymes

M. Froeyen, Sarfraz Ahmad, M. Qamar, 2019, Biology.

Targeting Natural Plant Metabolites for Hunting SARS-CoV-2 Omicron BA.1 Variant Inhibitors: Extraction, Molecular Docking, Molecular Dynamics, and Physicochemical Properties Study

Khaled S. Allemailem, K. Allemailem, Faris A Alrumaihi, 2022, Current issues in molecular biology.

Novel high-risk missense mutations identification in FAT4 gene causing Hennekam syndrome and Van Maldergem syndrome 2 through molecular dynamics simulation

I. Tuzankina, K. Shinwari, Guojun Liu, 2023, Informatics in Medicine Unlocked.

Rational design of novel potential EGFR inhibitors by 3D-QSAR, molecular docking, molecular dynamics simulation, and pharmacokinetics studies

M. Bouachrine, T. Lakhlifi, M. A. Ajana, 2022, Chemical Data Collections.

Enhanced Thermostability and Enzymatic Activity of cel6A Variants from Thermobifida fusca by Empirical Domain Engineering

M. Froeyen, R. Asghar, H. Alghamdi, 2020, Biology.

Molecular Characterization, Structural Modeling, and Evaluation of Antimicrobial Activity of Basrai Thaumatin-Like Protein against Fungal Infection

M. Saleem, Mamoona Naz, Roquyya Gul, 2017, BioMed research international.

Identification of RdRp inhibitors against SARS-CoV-2 through E-pharmacophore-based virtual screening, molecular docking and MD simulations approaches

M. U. Ghani, K. Shinwari, M. Rather, 2023, International Journal of Biological Macromolecules.

Identification of NS2B-NS3 Protease Inhibitors for Therapeutic Application in ZIKV Infection: A Pharmacophore-Based High-Throughput Virtual Screening and MD Simulations Approaches

Muhammad Akhtar Ali, M. U. Ghani, Muhammad Irfan, 2023, Vaccines.

Mechanistic insight of the potential of geraniol against Alzheimer’s disease

Y. Liu, H. M. Rehman, Shujing Zhou, 2022, European Journal of Medical Research.

A computer aided drug discovery based discovery of lead‐like compounds against KDM5A for cancers using pharmacophore modeling and high‐throughput virtual screening

M. Afzal, A. Tariq, Zeeshan Mutahir, 2021, Proteins.

Network Pharmacology-Based Approach Combined with Bioinformatic Analytics to Elucidate the Potential of Curcumol against Hepatocellular Carcinoma

A. Szöllősi, Xufeng Huang, H. M. Rehman, 2022, Genes.

Identification of RdRp inhibitors against SARS-CoV-2 through E-pharmacophore-based virtual screening, molecular docking and MD simulations approaches

M. U. Ghani, K. Shinwari, M. Rather, 2023, International Journal of Biological Macromolecules.

Protein Engineering of Endoglucanase CelR of Clostridium thermocellum for Enhanced Expression

M. Naseem, S. Z. Shah, A. Iqbal, 2019 .

3D-QSAR, molecular docking, simulation dynamic and ADMET studies on new quinolines derivatives against colorectal carcinoma activity

M. Bouachrine, T. Lakhlifi, M. A. Ajana, 2023, Journal of biomolecular structure & dynamics.

In Silico Investigation of a Chimeric IL24-LK6 Fusion Protein as a Potent Candidate Against Breast Cancer

Muhammad Aqib Shabbir, H. Bashir, H. M. Rehman, 2023, Bioinformatics and biology insights.

Discovery of inhibitors against SARS-CoV-2 associated fungal coinfections via virtual screening, ADMET evaluation, PASS, molecular docking, dynamics and pharmacophore studies

S. Goumri‐Said, K. Benarous, H. M. Rehman, 2022, Arab Journal of Basic and Applied Sciences.

A Computational Approach to Modeling an Antagonistic Angiogenic VEGFR1-IL2 Fusion Protein for Cancer Therapy

Tahreem Zaheer, M. Saleem, Roquyya Gul, 2021, Bioinformatics and biology insights.

Synthesis and studies of new purines/pyrimidine derivatives as multi-targeted agents involving various receptor sites in the immune system

G. Kaur, M. Bansal, H. M. Rehman, 2023, Molecular diversity.

A computational investigation of galactopyranoside esters as antimicrobial agents through antiviral, molecular docking, molecular dynamics, pharmacokinetics, and bioactivity prediction.

S. Kawsar, M. Saki, Mohammed A. Hosen, 2023, Journal of biomolecular structure & dynamics.

Synthesis, X-Ray Crystal Structure, and Identification of Potential Drug Candidate against COVID-19 Main Protease through Structure-Guided Modeling and Simulation Approach

J. Mague, Chin‐Hung Lai, G. Yeap, 2023, Polycyclic Aromatic Compounds.

Brief literature review and comprehensive bioinformatics analytics unravel the potential mechanism of curcumin in the treatment of periodontitis

Y. Liu, A. Szöllősi, Xufeng Huang, 2023, BMC Oral Health.

Exploring the therapeutic potential of galidesivir analogs against Zaire ebolavirus protein 24 (V24): database screening, molecular docking, drug-relevant property evaluation and molecular dynamics simulations.

H. Hassan, S. Abdelwahab, A. El-Sheikh, 2023, Journal of biomolecular structure & dynamics.

Computational Modeling, High-Level Soluble Expression and In Vitro Cytotoxicity Assessment of Recombinant Pseudomonas aeruginosa Azurin: A Promising Anti-Cancer Therapeutic Candidate

H. Yasmin, T. Nadeem, N. Ahmed, 2023, Pharmaceutics.

In-silico assessment of high-risk non-synonymous SNPs in ADAMTS3 gene associated with Hennekam syndrome and their impact on protein stability and function

I. Tuzankina, K. Shinwari, M. Bolkov, 2023, BMC Bioinformatics.

Whole proteome analysis of MDR Klebsiella pneumoniae to identify mRNA and multiple epitope based vaccine targets against emerging nosocomial and lungs associated infections.

Jawad Ul-Hassan, Thamer H Albekairi, H. M. Rehman, 2023, Journal of biomolecular structure & dynamics.

Exploring optimal drug targets through subtractive proteomics analysis and pangenomic insights for tailored drug design in tuberculosis

Maaz Waseem, H. M. Rehman, Sadiq Noor Khan, 2024, Scientific reports.