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Journal of Biomolecular Structure & Dynamics|May 17, 2023
Evaluation of the inhibitory potency of anti-dengue phytocompounds against DENV-2 NS2B-NS3 protease: virtual screening, ADMET profiling and molecular dynamics simulation investigationsPriyanka Purohit, Debashis Barik, Sidhartha Agasti, et al.Journal of Biomolecular Structure & Dynamics|May 16, 2023
Deciphering the structure of a distinctive trimodular cellulosomal licheninase (RfGH16_21), a family 16 glycoside hydrolase from Ruminococcus flavefaciens by computational and experimental methodsJebin Ahmed, Ashish Poonia, Arun GoyalJournal of Biomolecular Structure & Dynamics|May 19, 2023
Investigation of the mechanism of action of chemical constituents of celery seed against gout disease using network pharmacology, molecular docking, and molecular dynamics simulationsNguyen Thu Hang, Do Khai Han, Than Thi Kieu My, et al.Journal of Biomolecular Structure & Dynamics|May 19, 2023
Multitargeted molecular docking and dynamics simulation studies of flavonoids and volatile components from the peel of Citrus sinensis L. (Osbeck) against specific tumor protein markersGopalsamy Rajiv Gandhi, Chelankara Suresh Sharanya, Abhithaj Jayanandan, et al.Journal of Biomolecular Structure & Dynamics|May 22, 2023
Multispectroscopic and computational study of interaction of the bovine serum albumin with atropine and atropine-loaded chitosan nanoparticles (synthesized and characterized)Afreen Banu, Saeeda Naqvi, Mohssen T A Qashqoosh, et al.Journal of Biomolecular Structure & Dynamics|May 22, 2023
In silico identification and validation of phenolic lipids as potential inhibitor against bacterial and viral strainsKavita Khatana, Anjali Gupta, Anujit Ghosal, et al.Journal of Biomolecular Structure & Dynamics|May 22, 2023
Computational investigation of phytochemicals identified from medicinal plant extracts against tuberculosisNirmaladevi Ponnusamy, Girinath Pillai, Mohanapriya ArumugamJournal of Biomolecular Structure & Dynamics|November 20, 2012
Molecular dynamics simulations of retinoblastoma proteinC Ramakrishnan, V Subramanian, K Balamurugan, et al.Journal of Biomolecular Structure & Dynamics|February 1, 1990
The crystal structure of d(GTACGTAC) at 2.25 A resolution: are the A-DNA's always unwound approximately 10 degrees at the C-G steps?F TakusagawaJournal of Biomolecular Structure & Dynamics|February 1, 1990
Bh-DNA: variations of the poly[d(A)].poly[d(T)] structure within the framework of the fibre diffraction studiesA A Lipanov, V P Chuprina, D G Alexeev, et al.Pageof 935