QSAR and Pharmacophore Modeling of Nitrogen Heterocycles as Potent Human N-Myristoyltransferase (Hs-NMT) Inhibitors

por Zaki, Magdi E. A., Al-Hussain, Sami A., Masand, Vijay H., Akasapu, Siddhartha, Lewaa, Israa
Publicado 2021

Identification of Anti-SARS-CoV-2 Compounds from Food Using QSAR-Based Virtual Screening, Molecular Docking, and Molecular Dynamics Simulation Analysis

por Zaki, Magdi E. A., Al-Hussain, Sami A., Masand, Vijay H., Akasapu, Siddhartha, Bajaj, Sumit O., El-Sayed, Nahed N. E., Ghosh, Arabinda, Lewaa, Israa
Publicado 2021

QSAR based virtual screening derived identification of a novel hit as a SARS CoV-229E 3CL(pro) Inhibitor: GA-MLR QSAR modeling supported by molecular Docking, molecular dynamics si...

por Jawarkar, R.D., Bakal, Ravindrakumar L., Zaki, Magdi E.A., Al-Hussain, Sami, Ghosh, Arabinda, Gandhi, Ajaykumar, Mukerjee, Nobendu, Samad, Abdul, Masand, Vijay H., Lewaa, Israa
Publicado 2022

Identification of potent aldose reductase inhibitors as antidiabetic (Anti-hyperglycemic) agents using QSAR based virtual Screening, molecular Docking, MD simulation and MMGBSA app...

por Bakal, Ravindra L., Jawarkar, Rahul D., Manwar, J.V., Jaiswal, Minal S., Ghosh, Arabinda, Gandhi, Ajaykumar, Zaki, Magdi E.A., Al-Hussain, Sami, Samad, Abdul, Masand, Vijay H., Mukerjee, Nobendu, Nasir Abbas Bukhari, Syed, Sharma, Praveen, Lewaa, Israa
Publicado 2022