A Multiscale Coarse-grained Model of the SARS-CoV-2 Virion.

Alvin YuAlexander J PakPeng HeViviana Monje-GalvanLorenzo CasalinoZied GaiebAbigail C DommerRommie Elizabeth Amaro Gregory A Voth

Published in: bioRxiv : the preprint server for biology (2020)

This study reports the construction of a molecular model for the SARS-CoV-2 virion and details our multiscale approach towards model refinement. The resulting model and methods can be applied to and enable the simulation of SARS-CoV-2 virions.

Keyphrases

sars cov
respiratory syndrome coronavirus
molecular dynamics simulations
single molecule
adverse drug