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Journal of Biomolecular Structure & Dynamics|February 21, 2024
Machine learning and molecular simulation-based protocols to identify novel potential inhibitors for reverse transcriptase against HIV infectionsMuhammad Shahab, Guojun Zheng, Yousef A Bin Jardan, et al.Journal of Biomolecular Structure & Dynamics|February 14, 2024
Haplotype analysis, regulatory elements and docking simulation of structural models of different AT3 copies in the genus CapsicumEduardo Burgos-Valencia, Ileana Echevarría-Machado, Gustavo Ortega-Lule, et al.Journal of Biomolecular Structure & Dynamics|February 12, 2024
Structural, functional, molecular docking analysis of a hypothetical protein from Talaromyces marneffei and its molecular dynamic simulation: an in-silico approachMd Masudur Rahman Munna, Md Ariful Islam, Saima Sajnin Shanta, et al.Journal of Biomolecular Structure & Dynamics|February 2, 2024
Attenuation of Type IV pili activity by natural productsKerem Yalkut, Soumaya Ben Ali Hassine, Esra Basaran, et al.Journal of Biomolecular Structure & Dynamics|March 15, 2024
Potential diagnostic value of serum microRNAs for 19 cancer types: a meta-analysis of bioinformatics dataChauMyThanh Tran, PhongSon DinhJournal of Biomolecular Structure & Dynamics|March 15, 2024
In silico strategies for identifying therapeutic candidates against Acinetobacter baumannii: spotlight on the UDP-N-acetylmuramoyl-L-alanine-D-glutamate:meso-diaminopimelate ligase (MurE)Ankit Kumar, Pratyaksha Singh, Ekampreet Singh, et al.Journal of Biomolecular Structure & Dynamics|March 15, 2024
Zingiberaceae-derived phytomolecules inhibit Japanese encephalitis virus RNA dependent RNA polymerase: a molecular dynamics studyAftab Alam, Asma Anjum, Ehssan H Moglad, et al.Journal of Biomolecular Structure & Dynamics|March 31, 2024
MOCS, a novel classifier system integrated multimoics analysis refining molecular subtypes and prognosis for skin melanomaJuelan Ye, Fuchun Liu, Luoshen Zhang, et al.Journal of Biomolecular Structure & Dynamics|March 27, 2024
MD investigation on the differences in the dynamic interactions between the specific ligand azamulin and two CYP3A isoforms, 3A4 and 3A5Shuhui Liu, Tao Jing, Ran Jia, et al.Journal of Biomolecular Structure & Dynamics|March 26, 2024
Predicting anti-COVID-19 potential: in silico analysis of Mauritine compound from Ziziphus-spina christi as a promising papain-like protease (PLpro) inhibitorTaufik Muhammad Fakih, Fitrianti Darusman, Riry Apriliani, et al.Pageof 932