Impact of warhead modulations on the covalent inhibition of SARS-CoV-2 Mpro explored by QM/MM simulations (2021)
Attributed to:
Adaptive Multi-Resolution Massively-Multicore Hybrid Dynamics
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.33774/chemrxiv-2021-590p0
Publication URI: http://dx.doi.org/10.33774/chemrxiv-2021-590p0
Type: Preprint