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Solvated and generalised Born calculations differences using GPU CUDA and multi-CPU simulations of an antifreeze protein with AMBER
ArticleAbstract: While there has been an increase in the number of biomolecular computational studies employing graphPalabras claves:AMBER, antifreeze protein, CUDA, GPU, molecular dynamicsAutores:Antonio PeramoFuentes:scopusMolecular dynamics studies show solvation structure of type III antifreeze protein is disrupted at low pH
ArticleAbstract: Antifreeze proteins are a class of biological molecules of interest in many research and industrialPalabras claves:AMBER, antifreeze protein, molecular dynamics, Water solvationAutores:Antonio PeramoFuentes:scopus