Predicting the affinity of halogenated reversible covalent...

Physical Chemistry Chemical Physics 2019 Vol. 21; Iss. 44

Predicting the affinity of halogenated reversible covalent inhibitors through relative binding free energy

Lameira, Jerônimo, Bonatto, Vinícius, Cianni, Lorenzo, dos Reis Rocho, Fernanda, Leitão, Andrei, Montanari, Carlos A.
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Volume:
21
Year:
2019
Journal:
Physical Chemistry Chemical Physics
DOI:
10.1039/c9cp04820k
File:
PDF, 2.57 MB
2019
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