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Journal of Biomolecular Structure & Dynamics|August 18, 2016
GPCRs through the keyhole: the role of protein flexibility in ligand binding to β-adrenoceptorsAbigail L Emtage, Shailesh N Mistry, Peter M Fischer, et al.Journal of Biomolecular Structure & Dynamics|April 9, 2020
Targeting SARS-CoV-2: a systematic drug repurposing approach to identify promising inhibitors against 3C-like proteinase and 2'-O-ribose methyltransferaseRameez Jabeer Khan, Rajat Kumar Jha, Gizachew Muluneh Amera, et al.Journal of Biomolecular Structure & Dynamics|June 20, 2020
Investigating the role of N-terminal domain in phosphodiesterase 4B-inhibition by molecular dynamics simulationVidushi Sharma, Sharad WakodeJournal of Biomolecular Structure & Dynamics|June 20, 2020
Natural compounds from Clerodendrum spp. as possible therapeutic candidates against SARS-CoV-2: An in silico investigationPallab Kar, Neeta Raj Sharma, Bhupender Singh, et al.Journal of Biomolecular Structure & Dynamics|May 5, 2020
The biological activities, molecular docking studies, and anticancer effects of 1-arylsuphonylpyrazole derivativesParham Taslimi, Yavuz Erden, Sabir Mamedov, et al.Journal of Biomolecular Structure & Dynamics|May 5, 2020
To be ionized or not to be ionized: the vital role of physicochemical properties of galbanic acid derivatives in AChE assayAhmad Ebadi, Seyed Sajad Olyaie, Dara DastanJournal of Biomolecular Structure & Dynamics|May 5, 2020
Identification of novel antiplasmodial compound by hierarquical virtual screening and in vitro assaysDavid Bacelar Costa Júnior, Janay Stefany Carneiro Araújo, Larissa de Mattos Oliveira, et al.Journal of Biomolecular Structure & Dynamics|May 7, 2020
Formation of a DNA triple helical structure at BOLF1 gene of human herpesvirus 4 (HH4) genomeShikha Kaushik, Shrikant KukretiJournal of Biomolecular Structure & Dynamics|June 23, 2020
Constituents of buriti oil (Mauritia flexuosa L.) like inhibitors of the SARS-Coronavirus main peptidase: an investigation by docking and molecular dynamicsAllan N Costa, Ézio R A de Sá, Roosevelt D S Bezerra, et al.Journal of Biomolecular Structure & Dynamics|June 23, 2020
Virtual screening and dynamics of potential inhibitors targeting RNA binding domain of nucleocapsid phosphoprotein from SARS-CoV-2Rohitash Yadav, Mohammed Imran, Puneet Dhamija, et al.Pageof 930