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"Assessment of Reversibility for Covalent Cysteine Protease Inhibitors ..."
Alberto M. dos Santos et al. (2022)
- Alberto M. dos Santos, Amanda Ruslana Santana Oliveira, Clauber Henrique Costa
, Peter W. Kenny
, Carlos Alberto Montanari
, Jaldyr de Jesus G. Varela
, Jerônimo Lameira
:
Assessment of Reversibility for Covalent Cysteine Protease Inhibitors Using Quantum Mechanics/Molecular Mechanics Free Energy Surfaces. J. Chem. Inf. Model. 62(17): 4083-4094 (2022)
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