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Archiv Der Pharmazie|October 17, 2023
Design, synthesis, biological evaluation, and in silico studies of quinoxaline derivatives as potent p38α MAPK inhibitorsAnjali, Payal Kamboj, Ozair Alam, et al.Journal of Biochemical and Molecular Toxicology|September 5, 2023
Benzimidazole and piperidine containing novel 1,2,3-triazole hybrids as anti-infective agents: Design, synthesis, in silico and in vitro antimicrobial efficacyJigarkumar V Mendapara, Mahesh D Vaghasiya, Dhanji P Rajani, et al.Journal of Biomolecular Structure & Dynamics|May 23, 2023
Molecular modeling and biological investigation of novel s-triazine linked benzothiazole and coumarin hybrids as antimicrobial and antimycobacterial agentsAjayrajsinh R Zala, Dinesh Kumar, Uvais Razakhan, et al.Molecular Diversity|June 6, 2023
Microwave produced 8-methyl-1,2,4,8-tetraazaspiro[4.5]dec-2-en-3-amine derivatives: their in vitro and in silico analysisParth P Patel, Navin B Patel, Manesh S Tople, et al.Molecular Diversity|June 21, 2023
Design and synthesis of pyrrolo[2,3-d]pyrimidine linked hybrids as α-amylase inhibitors: molecular docking, MD simulation, ADMET and antidiabetic screeningAjayrajsinh R Zala, Ramgopal Tiwari, Hem N Naik, et al.Journal of Biomolecular Structure & Dynamics|January 17, 2022
Design, synthesis, molecular modeling, DFT, ADME and biological evaluation studies of some new 1,3,4-oxadiazole linked benzimidazoles as anticancer agents and aromatase inhibitorsUlviye Acar Çevik, Ismail Celik, Ayşen Işık, et al.Journal of Biomolecular Structure & Dynamics|January 17, 2022
Molecular modelling and structure-activity relationship of a natural derivative of o-hydroxybenzoate as a potent inhibitor of dual NSP3 and NSP12 of SARS-CoV-2: in silico studyYusuf Oloruntoyin Ayipo, Iqrar Ahmad, Yahaya Sani Najib, et al.Turkish Journal of Biology = Turk Biyoloji Dergisi|November 22, 2021
β-Carboline alkaloids induce structural plasticity and inhibition of SARS-CoV-2 nsp3 macrodomain more potently than remdesivir metabolite GS-441524: computational approachYusuf Oloruntoyin Ayipo, Sani Najib Yahaya, Halimah Funmilayo Babamale, et al.Molecular Diversity|February 7, 2023
Design and synthesis of some novel hybrid molecules based on 4-thiazolidinone bearing pyridine-pyrazole scaffolds: molecular docking and molecular dynamics simulations of its major constituent onto DNA gyrase inhibitionNisheeth C Desai, Dharmpalsinh J Jadeja, Aratiba M Jethawa, et al.Advances in Pharmacological and Pharmaceutical Sciences|April 5, 2024
Synthesis, Molecular Docking, Molecular Dynamic Simulation Studies, and Antitubercular Activity Evaluation of Substituted Benzimidazole DerivativesShankar Thapa, Mahalakshmi Suresha Biradar, Shachindra L Nargund, et al.Pageof 11