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ASU Team Models Molecular Structures on ORNL's Summit Supercomputer

Published: January 31, 2022

Jan. 31, 2022 -- Uncovering the molecular structures of proteins can help scientists elucidate biological functions of proteins and search for drug

Source: hpcwire.com

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United StatesAlberto PerezMrinal ShekharArizona State UniversityUniversity Of FloridaAbhishek Singharoy At Arizona State UniversityUs Department Of EnergyOak Ridge National LaboratoryOffice Of ScienceDaipayan Sarkar At Purdue UniversityUniversity Of Illinois At Urbana ChampaignAbhishek SingharoyOak Ridge Leadership Computing FacilityNovel Computational ImpactOak Ridge NationalDaipayan SarkarPurdue UniversityDetermining Protein StructuresData Guided Ensembles