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Journal of Biomolecular Structure & Dynamics|June 13, 2022
Identification of dual active sites in Caenorhabditis elegans GANA-1 protein: an ortholog of the human α-GAL a and α-NAGA enzymesClerance Su Yee Cheong, Shafi Ullah Khan, Nafees Ahmed, et al.Journal of Biomolecular Structure & Dynamics|June 14, 2022
Synthesis, characterisation, DNA binding, acetylcholinesterase (AChE) and butyrylcholinesterase (BuChE) activities and molecular docking studies of metal(II) complexes with 1,10-phenanthroline scaffoldE H Edinsha Gladis, K Nagashri, M Anisha, et al.Journal of Biomolecular Structure & Dynamics|June 17, 2022
Chlorhexidine as a Keap1-Nrf2 inhibitor: a new target for an old drug for Parkinson's disease therapySruthi Unni, Prashant Deshmukh, Gopinatha Krishnappa, et al.Journal of Biomolecular Structure & Dynamics|June 24, 2022
In-silico discovery of inhibitors against human papillomavirus E1 proteinJuliyan Gunasinghe, Siaw San Hwang, Wai Keat Yam, et al.Journal of Biomolecular Structure & Dynamics|June 24, 2022
Novel insights into the structural changes induced by disease-associated mutations in TDP-43: a computational approachAbhibhav Sharma, Pinki DeyJournal of Biomolecular Structure & Dynamics|June 27, 2022
Analysis of Pleurotin binding to human thioredoxin reductase using docking and molecular dynamics simulationDaniel B Quintanilha, Hélio F Dos SantosJournal of Biomolecular Structure & Dynamics|June 29, 2022
A combined in vitro-in silico approach for the discovery of novel endogenous enzymatic and ctDNA sequence of bioactive molecules from aerial and root parts of Centaurea sulphurea as antioxidant's agentsBenhamidat Lyna, Mesli Fouzia, Bensaid Okkacha, et al.Journal of Biomolecular Structure & Dynamics|January 8, 2021
Interactions of large T-Antigen (LT) protein of polyomaviruses with p53 unfold their cancerogenic potentialCaroline Kellogg, Valentina L Kouznetsova, Igor F TsigelnyJournal of Biomolecular Structure & Dynamics|January 11, 2021
ACE2-derived peptides interact with the RBD domain of SARS-CoV-2 spike glycoprotein, disrupting the interaction with the human ACE2 receptorPedro F N Souza, Jackson L Amaral, Leandro P Bezerra, et al.Journal of Biomolecular Structure & Dynamics|January 11, 2021
Novel copper complexes of metronidazole and metronidazole benzoate: synthesis, characterization, biological and computational studiesBushra Rafique, Kainat Shafique, Sabahat Hamid, et al.Pageof 931