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Journal of Biomolecular Structure & Dynamics|February 19, 2019
Membrane partitioning of peptide aggregates: coarse-grained molecular dynamics simulationsYu-Hsien Lien, Dhani Ram Mahato, Felix Hoppe-Seyler, et al.Journal of Biomolecular Structure & Dynamics|February 1, 1986
Terminators of transcription with RNA polymerase from Escherichia coli: what they look like and how to find themV Brendel, G H Hamm, E N TrifonovJournal of Biomolecular Structure & Dynamics|March 8, 2019
Molecular dynamics simulation revealed the intrinsic conformational change of cellular inhibitor of apoptosis protein-1Heng Xu, Zhengkuan Tang, Yu Zuo, et al.Journal of Biomolecular Structure & Dynamics|February 18, 2021
Metabolomic profiling of three Araucaria species, and their possible potential role against COVID-19Seham S El-Hawary, Mohamed A Rabeh, Mohamed A El Raey, et al.Journal of Biomolecular Structure & Dynamics|January 22, 2021
Structure-activity insights of harmine targeting DNA, ROS inducing cytotoxicity with PARP mediated apoptosis against cervical cancer, anti-biofilm formation and in vivo therapeutic studySarita Sarkar, Prosun Tribedi, Kakali BhadraJournal of Biomolecular Structure & Dynamics|January 25, 2021
Water-mediated structural rearrangement establishes active conformation of caspases for apoptosis and inflammationAnjaney Sharma, Prerana Gogoi, Monika Chandravanshi, et al.Journal of Biomolecular Structure & Dynamics|February 8, 2021
Effect of variations in the conserved residues E371 and S359 on the structural dynamics of protein Z dependent protease inhibitor (ZPI): a molecular dynamic simulation studySubash Chellam Gayathri, Suchetana Gupta, Aravind Suresh, et al.Journal of Biomolecular Structure & Dynamics|March 1, 2021
A potential peptide inhibitor of SARS-CoV-2 S and human ACE2 complexGrijesh Jaiswal, Shivani Yaduvanshi, Veerendra KumarJournal of Biomolecular Structure & Dynamics|March 1, 2021
Targeting allosteric pockets of SARS-CoV-2 main protease MproZahoor Ahmad Bhat, Dheeraj Chitara, Jawed Iqbal, et al.Journal of Biomolecular Structure & Dynamics|March 1, 2021
In silico exploration of hydroxylated polychlorinated biphenyls as estrogen receptor β ligands by 3D-QSAR, molecular docking and molecular dynamics simulationsFangfang Wang, Yingchao Qiu, Bo ZhouPageof 932