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Journal of Biomolecular Structure & Dynamics|January 18, 2021
Structure analysis of the proteins associated with polyA repeat expansion disordersRolando Hernandez, Julio C FacelliJournal of Biomolecular Structure & Dynamics|January 18, 2021
Identification of 1,2,3-triazole-phthalimide derivatives as potential drugs against COVID-19: a virtual screening, docking and molecular dynamic studyVanderlan Nogueira Holanda, Elton Marlon de Araújo Lima, Welson Vicente da Silva, et al.Journal of Biomolecular Structure & Dynamics|January 19, 2021
Rational design of PIN1 inhibitors for cancer treatment based on conformational diversity analysis and docking based virtual screeningJulián Maggio, Maia Cabrera, Romina Armando, et al.Journal of Biomolecular Structure & Dynamics|January 22, 2021
In silico evaluation of lapachol derivatives binding to the Nsp9 of SARS-CoV-2Nilson Nicolau Junior, Igor Andrade Santos, Bruno Amaral Meireles, et al.Journal of Biomolecular Structure & Dynamics|January 22, 2021
Virtual screening of epalrestat mimicking selective ALR2 inhibitors from natural product database: auto pharmacophore, ADMET prediction and molecular dynamics approachShalki Choudhary, Om SilakariJournal of Biomolecular Structure & Dynamics|January 22, 2021
Negative allosteric modulators of cannabinoid receptor 1: Ternary complexes including CB1, orthosteric CP55940 and allosteric ORG27569AyoOluwa O Aderibigbe, Pankaj Pandey, Robert J DoerksenJournal of Biomolecular Structure & Dynamics|January 22, 2021
Synthesis, characterization, molecular docking and in vitro screening of new metal complexes with coumarin Schiff base as anticholine esterase and antipancreatic cholesterol esterase agentsÖmer Şahin, Ümmühan Özmen Özdemir, Nurgül Seferoğlu, et al.Journal of Biomolecular Structure & Dynamics|January 6, 2022
Detailed investigation of catalytically important residues of class A β-lactamaseVidhu Agarwal, Tara Chand Yadav, Akhilesh Tiwari, et al.Journal of Biomolecular Structure & Dynamics|January 6, 2022
Synthesis, in vitro biological screening and docking study of benzo[d]oxazole bis Schiff base derivatives as a potent anti-Alzheimer agentMuhammad Taha, Fazal Rahim, Khalid Zaman, et al.Journal of Biomolecular Structure & Dynamics|January 7, 2022
Structural exploration of common pharmacophore based berberine derivatives as novel histone deacetylase inhibitor targeting HDACs enzymesSaravanan Kandasamy, Manikandan Selvaraj, Karthikeyan Muthusamy, et al.Pageof 930