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Journal of Biomolecular Structure & Dynamics|August 23, 2023
Computational assessment of lipid facilitated membrane permeation of vancomycin using force-probe molecular dynamic simulationMohabbat Ansari, Sajad Moradi, Simzar Hosseinzadeh, et al.Journal of Biomolecular Structure & Dynamics|August 23, 2023
An in-silico approach to the potential modulatory effect of taurine on sclerostin (SOST) and its probable role during osteoporosisMazumder Adhish, I ManjubalaJournal of Biomolecular Structure & Dynamics|August 23, 2023
Effect of cysteine mutation at Ca2+ coordinating residues to the autolysis, folding and hydrophobicity of full length and mature Rand protease: molecular dynamics simulation and essential dynamicsNur Aliyah Mohd Azrin, Mohd Shukuri Mohamad Ali, Raja Noor Zaliha Raja Abd Rahman, et al.Journal of Biomolecular Structure & Dynamics|August 22, 2023
Delineation of the CENP-LN sub-complex dissociation mechanism upon multisite phosphorylation during mitosisOlanrewaju Ayodeji DurojayeJournal of Biomolecular Structure & Dynamics|August 21, 2023
Theoretical, antioxidant, antidiabetic and in silico molecular docking and pharmacokinetics studies of heteroleptic oxovanadium(IV) complexes of thiosemicarbazone-based ligands and diclofenacSumeer Ahmed, Ummer Muhammed Rafi, Raju Senthil Kumar, et al.Journal of Biomolecular Structure & Dynamics|August 18, 2023
Phycocyanobilin is a new binding partner of human alpha-2-macroglobulin that protects the protein against oxidative stressMiloš Šunderić, Nikola Gligorijević, Miloš Milčić, et al.Journal of Biomolecular Structure & Dynamics|August 18, 2023
Identification of CXCR4 inhibitors as a key therapeutic small molecule in renal fibrosisSenthil Kumar G, Kishore N, Elakkiya Elumalai, et al.Journal of Biomolecular Structure & Dynamics|August 29, 2023
Pharmacological evaluations of amide carboxylates as potential anti-Alzheimer agents: anti-radicals, enzyme inhibition, simulation and behavioral studies in animal modelsMater H Mahnashi, Saqib Ali, Osama M Alshehri, et al.Journal of Biomolecular Structure & Dynamics|August 29, 2023
Investigating anti-inflammatory actions of marine algal compound against lipoxygenase concentrating on therapeutic applications through computational approachAkanksha Dubey, Jayanthi SivaramanJournal of Biomolecular Structure & Dynamics|August 29, 2023
Molecularly imprinted polymer-based sensors for identification volatile compounds in pharmaceutical products: in silico rational designTaufik Muhammad FakihPageof 931