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Structural Chemistry|October 24, 2022
Targeting COVID-19 pandemic: in silico evaluation of 2-hydroxy-1, 2-diphenylethanone N(4)-methyl-N(4)-phenylthiosemicarbazone as a potential inhibitor of SARS-CoV-2Rajan Jeevana, Abu Pilakkaveettil Kavitha, Thoppilan G Abi, et al.Structural Chemistry|May 4, 2022
In silico investigation of phytoconstituents from Cameroonian medicinal plants towards COVID-19 treatmentSamir Chtita, Romuald Tematio Fouedjou, Salah Belaidi, et al.Structural Chemistry|August 25, 2020
Unravelling the regio- and stereoselective synthesis of bicyclic N,O-nucleoside analogues within the molecular electron density theory perspectiveNivedita AcharjeeStructural Chemistry|August 25, 2020
How the ascorbic acid and hesperidin do improve the biological activities of the cinnamon: theoretical investigationBachir ZouchouneStructural Chemistry|June 22, 2022
Study of nonlinear optical responses of phytochemicals of Clitoria ternatea by quantum mechanical approach and investigation of their anti-Alzheimer activity with in silico approachShradha Lakhera, Kamal Devlal, Meenakshi Rana, et al.Structural Chemistry|June 22, 2022
Phytochemicals as potential inhibitors for COVID-19 revealed by molecular docking, molecular dynamic simulation and DFT studiesVinduja Puthanveedu, Karuvanthodi MuraleedharanStructural Chemistry|June 7, 2022
Integrated computational approach towards repurposing of antimalarial drug against SARS-CoV-2 main proteaseNeelutpal Gogoi, Purvita Chowdhury, Ashis Kumar Goswami, et al.Structural Chemistry|May 16, 2022
Antiviral phytocompounds "ellagic acid" and "(+)-sesamin" of Bridelia retusa identified as potential inhibitors of SARS-CoV-2 3CL pro using extensive molecular docking, molecular dynamics simulation studies, binding free energy calculations, and bioactivity predictionAbd Kakhar Umar, James H Zothantluanga, Keerthic Aswin, et al.Structural Chemistry|February 15, 2021
The Nobel Prize in Physiology or Medicine-2020Krisztina HagymásiStructural Chemistry|July 25, 2022
Synthesis and DFT analysis of non-covalent interactions in crystal structures of 6-R-2-alkoxy-, 2,3-di-, and 2,2,3-tri-tert-butylpyrrolo[1,2-b][1,2,4]triazinesDenis S Koltun, Sergey M IvanovPageof 8