AI-driven multiscale simulations illuminate mechanisms of SARS-CoV-2 spike dynamicsSpecial Issue Papers Published on 2021-09-012022-10-29 Journal: The International Journal of High Performance Computing Applications [Category] COVID-19, [키워드] accelerate AI Complete complex computational virology conformational COVID19 deep learning develop flexible glycan GPU heterogeneous HPC human ACE2 receptor Interaction mechanism modulating molecular molecular dynamics multiscale simulation resource SARS-CoV-2 SARS-CoV-2 spike SARS-CoV-2 viral Spike protein Summit the SARS-CoV-2 variety viral infection virus weighted ensemble [DOI] 10.1177/10943420211006452 PMC 바로가기 [Article Type] Special Issue Papers