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Computational Biology and Chemistry
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December 31, 2024
e-QSAR (Explainable AI-QSAR), molecular docking, and ADMET analysis of structurally diverse GSK3-beta modulators to identify concealed modulatory features vindicated by X-ray
Vijay H Masand, Sami Al-Hussain, Gaurav S Masand, et al.
Expert Opinion on Drug Discovery
|
October 9, 2023
Leveraging nitrogen occurrence in approved drugs to identify structural patterns
Vijay H Masand, Sami Al-Hussain, Abdullah Y Alzahrani, et al.
Arabian Journal of Chemistry
|
December 15, 2021
QSAR based virtual screening derived identification of a novel hit as a SARS CoV-229E 3CL<sup>pro</sup> Inhibitor: GA-MLR QSAR modeling supported by molecular Docking, molecular dynamics simulation and MMGBSA calculation approaches
R D Jawarkar, Ravindrakumar L Bakal, Magdi E A Zaki, et al.
Expert Opinion on Drug Discovery
|
June 20, 2024
Unveiling dynamics of nitrogen content and selected nitrogen heterocycles in thrombin inhibitors: a <i>ceteris paribus</i> approach
Vijay H Masand, Sami Al-Hussain, Abdullah Y Alzahrani, et al.
Saudi Pharmaceutical Journal : SPJ : the Official Publication of the Saudi Pharmaceutical Society
|
July 11, 2022
Identification of potent aldose reductase inhibitors as antidiabetic (Anti-hyperglycemic) agents using QSAR based virtual Screening, molecular Docking, MD simulation and MMGBSA approaches
Ravindra L Bakal, Rahul D Jawarkar, J V Manwar, et al.
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Search research articles
Search
Showing results (1-10 of 5) with videos related to
Sort By:
Page
of 1
Computational Biology and Chemistry
|
December 31, 2024
e-QSAR (Explainable AI-QSAR), molecular docking, and ADMET analysis of structurally diverse GSK3-beta modulators to identify concealed modulatory features vindicated by X-ray
Vijay H Masand, Sami Al-Hussain, Gaurav S Masand, et al.
Expert Opinion on Drug Discovery
|
October 9, 2023
Leveraging nitrogen occurrence in approved drugs to identify structural patterns
Vijay H Masand, Sami Al-Hussain, Abdullah Y Alzahrani, et al.
Arabian Journal of Chemistry
|
December 15, 2021
QSAR based virtual screening derived identification of a novel hit as a SARS CoV-229E 3CL<sup>pro</sup> Inhibitor: GA-MLR QSAR modeling supported by molecular Docking, molecular dynamics simulation and MMGBSA calculation approaches
R D Jawarkar, Ravindrakumar L Bakal, Magdi E A Zaki, et al.
Expert Opinion on Drug Discovery
|
June 20, 2024
Unveiling dynamics of nitrogen content and selected nitrogen heterocycles in thrombin inhibitors: a <i>ceteris paribus</i> approach
Vijay H Masand, Sami Al-Hussain, Abdullah Y Alzahrani, et al.
Saudi Pharmaceutical Journal : SPJ : the Official Publication of the Saudi Pharmaceutical Society
|
July 11, 2022
Identification of potent aldose reductase inhibitors as antidiabetic (Anti-hyperglycemic) agents using QSAR based virtual Screening, molecular Docking, MD simulation and MMGBSA approaches
Ravindra L Bakal, Rahul D Jawarkar, J V Manwar, et al.
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of 1