AlphaFold2 Workflow Optimization for High Throughput Predictions in HPC Environment

Edwin Fernando Posada, Francisco McGee, Richard Berger, Mitchell Dorrell, Jason Lamanna, Sergiu Sanielevici, Vincenzo Carnevale. AlphaFold2 Workflow Optimization for High Throughput Predictions in HPC Environment. In Julie Wernert, Alan Chalker, Shava Smallen, Tabitha K. Samuel, John-Paul Navarro, editors, PEARC '22: Practice and Experience in Advanced Research Computing, Boston, MA, USA, July 10 - 14, 2022. ACM, 2022. [doi]

Abstract

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