Atomic-level investigation of KCNJ2 mutations associated with ventricular arrhythmic syndrome phenotypes
April 02, 2025
Scientific Reports - Volume:15, Issue:1, Article Number: 11290
Predictive Tox-21 Methods for Assessing Emerging Pollutants in the Marine Environment
March 01, 2025
Recent Trends in Marine Toxicological Assessment - 1st Edition, Chapter 16, Pages 403-442
Challenges of Protein-Protein Docking of the Membrane Proteins
July 11, 2024
Book on Protein-Protein Docking: Methods in Molecular Biology - Chapter 12, Volume:2780, Page:203-255
Structural and functional insight into a new emerging target IP3R in cancer
April 17, 2023
Journal of Biomolecular Structure and Dynamics - Pages 1-27
Identification and Empiric Evaluation of New Inhibitors of the Multidrug Transporter P-Glycoprotein (ABCB1)
March 10, 2023
International Journal of Molecular Sciences - Volume 24, Issue 6, Article Number
Decoding the Role of Epigenetics in Breast Cancer Using Formal Modeling and Machine-Learning Methods
July 11, 2022
Frontiers in Molecular Biosciences - Volume 9, Article Number 882738
Lipophilic Metabolic Efficiency (LipMetE) and Drug Efficiency Indices to Explore the Metabolic Properties of the Substrates of Selected Cytochrome P450 Isoforms
January 01, 2020
ACS Omega - Volume 5(1), Pages 179-188
Molecular Dynamics Simulation Framework to Probe the Binding Hypothesis of CYP3A4 Inhibitors
September 10, 2019
International Journal of Molecular Sciences - Volume 20, Issue 18, Article Number 4468
Exploring the Chemical Space of Cytochrome P450 Inhibitors Using Integrated Physicochemical Parameters, Drug Efficiency Metrics and Decision Tree Models
May 24, 2019
COMPUTATION - Volume 7, Issue 2
Molecular docking simulations and GRID-independent molecular descriptor (GRIND) analysis to probe stereoselective interactions of CYP3A4 inhibitors
October 01, 2017
Medicinal Chemistry Research - Volume: 26 Issue: 10 Pages: 2322-2335