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Ecotoxicology and Environmental Safety
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June 16, 2012
Development of classification and regression based QSAR models to predict rodent carcinogenic potency using oral slope factor
Supratik Kar, Omar Deeb, Kunal Roy
International Journal of Biological Macromolecules
|
August 31, 2025
Unveiling G protein-coupled inwardly-rectifying potassium channel 4 (GIRK4) inverse agonists: A novel simulation-driven approach leveraging cellular ion flow coupled with chemometrics and protein conformational dynamics
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha
Materials (Basel, Switzerland)
|
July 19, 2019
Optoelectronic Properties of C<sub>60</sub> and C<sub>70</sub> Fullerene Derivatives: Designing and Evaluating Novel Candidates for Efficient P3HT Polymer Solar Cells
Juganta K Roy, Supratik Kar, Jerzy Leszczynski
Molecular Diversity
|
March 9, 2024
First report on chemometrics-driven multilayered lead prioritization in addressing oxysterol-mediated overexpression of G protein-coupled receptor 183
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha
Current Pharmaceutical Design
|
March 7, 2019
Recent Advances of In-Silico Modeling of Potent Antagonists for the Adenosine Receptors
Pabitra Narayan Samanta, Supratik Kar, Jerzy Leszczynski
ACS Omega
|
April 14, 2025
pDILI_v1: A Web-Based Machine Learning Tool for Predicting Drug-Induced Liver Injury (DILI) Integrating Chemical Space Analysis and Molecular Fingerprints
Sk Abdul Amin, Supratik Kar, Stefano Piotto
Scientific Reports
|
January 13, 2026
KidneyTox_v1.0 enables explainable artificial intelligence prediction of nephrotoxicity in small molecules
Sk Abdul Amin, Supratik Kar, Stefano Piotto
Computational Biology and Chemistry
|
January 17, 2025
Ligand-based cheminformatics and free energy-inspired molecular simulations for prioritizing and optimizing G-protein coupled receptor kinase-6 (GRK6) inhibitors in multiple myeloma treatment
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha
International Journal of Biological Macromolecules
|
May 2, 2024
Unveiling G-protein coupled receptor kinase-5 inhibitors for chronic degenerative diseases: Multilayered prioritization employing explainable machine learning-driven multi-class QSAR, ligand-based pharmacophore and free energy-inspired molecular simulation
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha
Molecules (Basel, Switzerland)
|
July 29, 2023
Computational Modeling of Human Serum Albumin Binding of Per- and Polyfluoroalkyl Substances Employing QSAR, Read-Across, and Docking
Andrea Gallagher, Supratik Kar, Maria S SepĂșlveda
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of 9
Search research articles
Search
Showing results (41-50 of 88) with videos related to
Sort By:
Page
of 9
Ecotoxicology and Environmental Safety
|
June 16, 2012
Development of classification and regression based QSAR models to predict rodent carcinogenic potency using oral slope factor
Supratik Kar, Omar Deeb, Kunal Roy
International Journal of Biological Macromolecules
|
August 31, 2025
Unveiling G protein-coupled inwardly-rectifying potassium channel 4 (GIRK4) inverse agonists: A novel simulation-driven approach leveraging cellular ion flow coupled with chemometrics and protein conformational dynamics
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha
Materials (Basel, Switzerland)
|
July 19, 2019
Optoelectronic Properties of C<sub>60</sub> and C<sub>70</sub> Fullerene Derivatives: Designing and Evaluating Novel Candidates for Efficient P3HT Polymer Solar Cells
Juganta K Roy, Supratik Kar, Jerzy Leszczynski
Molecular Diversity
|
March 9, 2024
First report on chemometrics-driven multilayered lead prioritization in addressing oxysterol-mediated overexpression of G protein-coupled receptor 183
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha
Current Pharmaceutical Design
|
March 7, 2019
Recent Advances of In-Silico Modeling of Potent Antagonists for the Adenosine Receptors
Pabitra Narayan Samanta, Supratik Kar, Jerzy Leszczynski
ACS Omega
|
April 14, 2025
pDILI_v1: A Web-Based Machine Learning Tool for Predicting Drug-Induced Liver Injury (DILI) Integrating Chemical Space Analysis and Molecular Fingerprints
Sk Abdul Amin, Supratik Kar, Stefano Piotto
Scientific Reports
|
January 13, 2026
KidneyTox_v1.0 enables explainable artificial intelligence prediction of nephrotoxicity in small molecules
Sk Abdul Amin, Supratik Kar, Stefano Piotto
Computational Biology and Chemistry
|
January 17, 2025
Ligand-based cheminformatics and free energy-inspired molecular simulations for prioritizing and optimizing G-protein coupled receptor kinase-6 (GRK6) inhibitors in multiple myeloma treatment
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha
International Journal of Biological Macromolecules
|
May 2, 2024
Unveiling G-protein coupled receptor kinase-5 inhibitors for chronic degenerative diseases: Multilayered prioritization employing explainable machine learning-driven multi-class QSAR, ligand-based pharmacophore and free energy-inspired molecular simulation
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha
Molecules (Basel, Switzerland)
|
July 29, 2023
Computational Modeling of Human Serum Albumin Binding of Per- and Polyfluoroalkyl Substances Employing QSAR, Read-Across, and Docking
Andrea Gallagher, Supratik Kar, Maria S SepĂșlveda
Page
of 9