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Journal of Biomolecular Structure & Dynamics|October 31, 2017
Virtual identification of novel PPARα/γ dual agonists by scaffold hopping of saroglitazarWen-Qing Jia, Zhi Jing, Xin Liu, et al.
Journal of Biomolecular Structure & Dynamics|December 12, 2018
Identification of new promising plant-based lead compounds for inhibition of prokaryotic replicative DNA polymerases: combination of in silico and in vitro studiesMilad Lagzian, Ali Qasemi, Pegah Kaviani, et al.
Journal of Biomolecular Structure & Dynamics|December 12, 2018
Validation of NAD synthase inhibitors for inhibiting the cell viability of Leishmania donovani: In silico and in vitro approachHaraprasad Mandal, Saravanan Vijayakumar, Shalini Yadav, et al.
Journal of Biomolecular Structure & Dynamics|December 12, 2018
In vitro cytotoxicity studies of parent and nanoencapsulated Holmium-2,9-dimethyl-1,10-phenanthroline complex toward fish-salmon DNA-binding properties and antibacterial activityShohreh Jahani, Meissam Noroozifar, Mozhgan Khorasani-Motlagh, et al.
Journal of Biomolecular Structure & Dynamics|August 15, 2017
A QM protein-ligand investigation of antipsychotic drugs with the dopamine D2 Receptor (D2R)Ramin Ekhteiari Salmas, Yusuf Serhat Is, Serdar Durdagi, et al.
Journal of Biomolecular Structure & Dynamics|August 15, 2017
Novel approach for structural identification of protein family: glyoxalase IAnton M Kargatov, Eugenia A Boshkova, Yuri N Chirgadze
Journal of Biomolecular Structure & Dynamics|August 18, 2017
Elucidation of molecular mechanism of stability of the heme-regulated eIF2α kinase upon binding of its ligand, hemin in its catalytic kinase domainVarsha Bhavnani, Swarnendu Kaviraj, Priyabrata Panigrahi, et al.
Journal of Biomolecular Structure & Dynamics|January 25, 2019
In silico identification of mimicking molecule(s) triggering von Willebrand factor in human: a molecular drug target for regulating coagulation pathwayGarima Rana, Rajesh Kumar Pathak, Rohit Shukla, et al.
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