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Journal of Molecular Graphics & Modelling
|
January 17, 2026
Exploring traditional Chinese medicine for antiviral drug discovery: A computational approach to combat human metapneumovirus (HMPV)
Amit Dubey, Manish Kumar, Aisha Tufail, et al.
Molecular Diversity
|
September 3, 2024
Identification of potential NUDT5 inhibitors from marine bacterial natural compounds via molecular dynamics and free energy landscape analysis
Amit Dubey, Amer M Alanazi, Rima Bhardwaj, et al.
Biochemical and Biophysical Research Communications
|
March 16, 2016
Interaction of human chymase with ginkgolides, terpene trilactones of Ginkgo biloba investigated by molecular docking simulations
Amit Dubey, Anna Marabotti, Pramod W Ramteke, et al.
Scientific Reports
|
September 23, 2023
Investigation of antituberculosis, antimicrobial, anti-inflammatory efficacies of newly synthesized transition metal(II) complexes of hydrazone ligands: structural elucidation and theoretical studies
Binesh Kumar, Jai Devi, Amit Dubey, et al.
Biometals : an International Journal on the Role of Metal Ions in Biology, Biochemistry, and Medicine
|
November 8, 2023
Exploring the antimalarial and antioxidant efficacy of transition metal(II) chelates of thiosemicarbazone ligands: spectral investigations, molecular docking, DFT, MESP and ADMET
Jai Devi, Binesh Kumar, Amit Dubey, et al.
Nanoscale
|
August 14, 2025
Ti<sub>3</sub>C<sub>2</sub>O<sub>2</sub> MXene as a dual-action modulator of inflammatory and tuberculosis signaling: structural and <i>in vitro</i> insights
Satyam Tripathi, Manish Kumar, Aisha Tufail, et al.
Heliyon
|
May 30, 2023
Synthesis, spectroscopic investigation, molecular docking, ADME/T toxicity predictions, and DFT study of two trendy ortho vanillin-based scaffolds
Dhrubajyoti Majumdar, Amit Dubey, Aisha Tufail, et al.
Future Medicinal Chemistry
|
November 6, 2023
Biological and computational investigation of transition metal(II) complexes of 2-phenoxyaniline-based ligands
Binesh Kumar, Jai Devi, Amit Dubey, et al.
Scientific Reports
|
March 19, 2026
Allophycocyanin inhibits HIV-1 gp120 and reverse transcriptase through enthalpy-driven binding and antioxidative protection: integrative computational and experimental insights
Amit Dubey, Manish Kumar, Aisha Tufail, et al.
Journal of Infection and Public Health
|
July 5, 2025
Unlocking antiviral potentials of traditional plants: A multi-method computational study against human metapneumovirus (HMPV)
Amit Dubey, Manish Kumar, Aisha Tufail, et al.
Page
of 9
Search research articles
Search
Showing results (11-20 of 90) with videos related to
Sort By:
Page
of 9
Journal of Molecular Graphics & Modelling
|
January 17, 2026
Exploring traditional Chinese medicine for antiviral drug discovery: A computational approach to combat human metapneumovirus (HMPV)
Amit Dubey, Manish Kumar, Aisha Tufail, et al.
Molecular Diversity
|
September 3, 2024
Identification of potential NUDT5 inhibitors from marine bacterial natural compounds via molecular dynamics and free energy landscape analysis
Amit Dubey, Amer M Alanazi, Rima Bhardwaj, et al.
Biochemical and Biophysical Research Communications
|
March 16, 2016
Interaction of human chymase with ginkgolides, terpene trilactones of Ginkgo biloba investigated by molecular docking simulations
Amit Dubey, Anna Marabotti, Pramod W Ramteke, et al.
Scientific Reports
|
September 23, 2023
Investigation of antituberculosis, antimicrobial, anti-inflammatory efficacies of newly synthesized transition metal(II) complexes of hydrazone ligands: structural elucidation and theoretical studies
Binesh Kumar, Jai Devi, Amit Dubey, et al.
Biometals : an International Journal on the Role of Metal Ions in Biology, Biochemistry, and Medicine
|
November 8, 2023
Exploring the antimalarial and antioxidant efficacy of transition metal(II) chelates of thiosemicarbazone ligands: spectral investigations, molecular docking, DFT, MESP and ADMET
Jai Devi, Binesh Kumar, Amit Dubey, et al.
Nanoscale
|
August 14, 2025
Ti<sub>3</sub>C<sub>2</sub>O<sub>2</sub> MXene as a dual-action modulator of inflammatory and tuberculosis signaling: structural and <i>in vitro</i> insights
Satyam Tripathi, Manish Kumar, Aisha Tufail, et al.
Heliyon
|
May 30, 2023
Synthesis, spectroscopic investigation, molecular docking, ADME/T toxicity predictions, and DFT study of two trendy ortho vanillin-based scaffolds
Dhrubajyoti Majumdar, Amit Dubey, Aisha Tufail, et al.
Future Medicinal Chemistry
|
November 6, 2023
Biological and computational investigation of transition metal(II) complexes of 2-phenoxyaniline-based ligands
Binesh Kumar, Jai Devi, Amit Dubey, et al.
Scientific Reports
|
March 19, 2026
Allophycocyanin inhibits HIV-1 gp120 and reverse transcriptase through enthalpy-driven binding and antioxidative protection: integrative computational and experimental insights
Amit Dubey, Manish Kumar, Aisha Tufail, et al.
Journal of Infection and Public Health
|
July 5, 2025
Unlocking antiviral potentials of traditional plants: A multi-method computational study against human metapneumovirus (HMPV)
Amit Dubey, Manish Kumar, Aisha Tufail, et al.
Page
of 9