Mutational analysis in international isolates and drug repurposing against SARS-CoV-2 spike protein: molecular docking and simulation approach
Swetha Pulakuntla, Kiran Bharat Lokhande, P. Padmavathi, Meena Pal, K. Venkateswara Swamy, S. Jayashree, Shri Abhiav Singh, Sree Latha Aramgam, Vaddi Damodara Reddy
Topics & Concepts
Spike (software development)BiologyRepurposingVirologyCoronavirusSpike ProteinDrug repositioningOpen reading framePeptide sequenceSequence analysisComputational biologySequence (biology)Multiple sequence alignmentSequence alignmentGeneticsCoronavirus disease 2019 (COVID-19)GeneInfectious disease (medical specialty)DrugMedicineDiseasePathologyEconomicsEcologyManagementPharmacologySARS-CoV-2 and COVID-19 ResearchComputational Drug Discovery Methodsvaccines and immunoinformatics approaches