Journal of Biomolecular Structure and Dynamics Identification of a novel drug molecule for neurodegenerative disease from marine algae through in-silico analysis. By , 8 months ago
Journal of Biomolecular Structure and Dynamics The effect of phosphorylation on the conformational dynamics and allostery of the association of death-associated protein kinase with calmodulin. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Exploration of novel hydroxamate zinc binding group inhibitors against HDAC-1-3 enzymes by AI-based virtual screening: atomistic insights from steered molecular dynamics. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Deep-VEGF: deep stacked ensemble model for prediction of vascular endothelial growth factor by concatenating gated recurrent unit with two-dimensional convolutional neural network. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Deep-VEGF: deep stacked ensemble model for prediction of vascular endothelial growth factor by concatenating gated recurrent unit with two-dimensional convolutional neural network. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Cytotoxic monastrol derivatives as adjective inhibitors of drug-resistant Eg5: a molecular dynamics perspective. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Distinct characteristics of putative archaeal 5-methylcytosine RNA methyltransferases unveil their substrate specificities and evolutionary ancestries. By , 8 months ago
Journal of Biomolecular Structure and Dynamics In silico development of a novel anti-mutation, multi-epitope mRNA vaccine against MPXV variants of emerging lineage and sub-lineages by using immunoinformatics approaches. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Repurposing of SARS-CoV-2 compounds against Marburg Virus using MD simulation, mm/GBSA, PCA analysis, and free energy landscape. By , 8 months ago
Journal of Biomolecular Structure and Dynamics Deep-VEGF: deep stacked ensemble model for prediction of vascular endothelial growth factor by concatenating gated recurrent unit with two-dimensional convolutional neural network. By , 8 months ago