A framework for analyzing single-cell genomics data, in which geometrical properties are harnessed to obtain insights on cellular diversity, including precise clustering, clear visualizations, and ...
High-Throughput Virtual Screening and Validation of a SARS-CoV-2 Main Protease Noncovalent Inhibitor
High-throughput docking was implemented using RADICAL-Pilot (RP) and RAPTOR. (21) RP is a pilot-enabled runtime system, while RAPTOR is a scalable master/worker overlay developed to improve the ...
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