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Impact of warhead modulations on the covalent inhibition of SARS-CoV-2 Mpro explored by QM/MM simulations (2021)

First Author: Marti S

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/10.26434/chemrxiv-2021-590p0

Publication URI: http://dx.doi.org/10.26434/chemrxiv-2021-590p0

Type: Preprint