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Journal of Biomolecular Structure & Dynamics|January 5, 2021
Virtual screening of curcumin and its analogs against the spike surface glycoprotein of SARS-CoV-2 and SARS-CoVAshish Patel, Malathi Rajendran, Ashish Shah, et al.Journal of Biomolecular Structure & Dynamics|December 22, 2020
In-silico identification of new inhibitors for Low-density lipoprotein receptor-related protein6 (LRP6)Maryam Enayatkhani, Mona Salimi, Kayhan Azadmanesh, et al.Journal of Biomolecular Structure & Dynamics|December 10, 2022
Rotations of F-ATPase and V-ATPase analyzed by a torque approachKulpavee Jitapunkul, Yanling Zhao, Luckhana Lawtrakul, et al.Journal of Biomolecular Structure & Dynamics|December 17, 2020
Comparative molecular dynamics study of the receptor-binding domains in SARS-CoV-2 and SARS-CoV and the effects of mutations on the binding affinityShokouh Rezaei, Yahya Sefidbakht, Vuk UskokovićJournal of Biomolecular Structure & Dynamics|July 5, 2021
Comprehensive profiling of aroma imparting biomolecules in foliar extract of Hibiscus fragrans Roxburgh: a metabologenesis perspectiveSourav Chakraborty, Soumya Majumder, Arindam Ghosh, et al.Journal of Biomolecular Structure & Dynamics|May 6, 2022
Impact of compound mutations I1171N + F1174I and I1171N + L1198H on the structure of ALK in NSCLC pathogenesis: atomistic insightsElliasu Y Salifu, Issahaku A Rashid, Mahmoud E S SolimanJournal of Biomolecular Structure & Dynamics|July 28, 2021
Computational study of DMPC liposomes loaded with the N-(2-Hydroxyphenyl)-2-propylpentanamide (HO-AAVPA) and determination of its antiproliferative activity in vitro in NIH-3T3 cellsXelhua Marcos, Yudibeth Sixto-López, Silvia Pérez-Casas, et al.Journal of Biomolecular Structure & Dynamics|July 30, 2021
In-silico study on viability of MXenes in suppressing the coronavirus infection and distributionEbrahim Ghasemy, Ahmad Miri Jahromi, Mohammad Khedri, et al.Journal of Biomolecular Structure & Dynamics|July 30, 2021
Protein degradation: a novel computational approach to design protein degrader probes for main protease of SARS-CoV-2Muhammed Shaheer, Ravi Singh, M Elizabeth SobhiaJournal of Biomolecular Structure & Dynamics|July 30, 2021
Validating the predictions of murburn model for oxygenic photosynthesis: Analyses of ligand-binding to protein complexes and cross-system comparisonsKelath Murali Manoj, Daniel Andrew Gideon, Abhinav Parashar, et al.Pageof 931