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Journal of Biomolecular Structure & Dynamics|July 28, 2023
Mechanistic insights into the allosteric inactivation mechanism of ZAP-70 induced by the hot spot W165C mutationMing-Tai Hu, Wen-Cong Ma, Jing-Han Wang, et al.Journal of Biomolecular Structure & Dynamics|July 28, 2023
Insights into in-vitro studies and molecular modelling of the antimicrobial efficiency of 4-chlorobenzaldehyde and 4-methoxybenzaldehyde derivativesMashood A F Mohamed, Innocent Benjamin, Gideon A Okon, et al.Journal of Biomolecular Structure & Dynamics|March 18, 2026
Spectroscopic and molecular docking studies of coumarin derivatives with HSA: bilirubin displacement and theranostic potentialBi Bi Ayisha Mulla, Aravind R Nesaragi, Ravindra R Kamble, et al.Journal of Biomolecular Structure & Dynamics|April 15, 2026
Site-specific post-translational modifications regulate the binding affinity of Conus amadis α-conotoxin Am2005 to Ac-AChBPShweta Dhannura, Marimuthu Vijayasarathy, Kashibai Patil, et al.Journal of Biomolecular Structure & Dynamics|April 16, 2026
Rational design of novel α-amylase inhibitor peptide derived from quinoa seed peptide with in silico approachesRachmannisa Amalia Putri, Ahmad Habibie, Tendy Oktriawan, et al.Journal of Biomolecular Structure & Dynamics|April 1, 2026
Exploring natural phenolic compounds as amyloid-beta fibril inhibitors: computational insights for Alzheimer's diseaseRakibul Islam, Devendra Kumar DhakedJournal of Biomolecular Structure & Dynamics|April 10, 2026
Molecular insights into the binding of curcumin, γ-oryzanol, and sesamin to cyclooxygenase-2 (COX-2): a computational studyPeerayut Dammak, Borvornwat Toviwek, Sittichai Daengprasert, et al.Journal of Biomolecular Structure & Dynamics|March 23, 2026
Precision targeting of BTK in chronic lymphocytic leukemia: computational insights into structural dynamics and the influence of mutations on BTK inhibitors through QM and MM studiesSafrina Zeenat Hussain, Manisha Agarwal, Sanchaita Rajkhowa, et al.Journal of Biomolecular Structure & Dynamics|April 23, 2024
Phytochemical analysis and antioxidant potential of Mondia whitei and Guibourtia tessmannii against H2O2-induced cytotoxicity in PC3 cellsPatrick Brice Defo Deeh, Anbazhagan Sathiyaseelan, Kumar Vishven Naveen, et al.Journal of Biomolecular Structure & Dynamics|April 11, 2024
COVID-19 diagnostic prediction on chest CT scan images using hybrid quantum-classical convolutional neural networkHaorong Zhao, Xing Deng, Haijian Shao, et al.Pageof 932