Covalent inhibitor reactivity prediction by the electrophilicity index - in and out of scope

Markus R. Hermann, Alexander Pautsch, Marc A. Grundl, Alexander Weber, Christofer S. Tautermann. Covalent inhibitor reactivity prediction by the electrophilicity index - in and out of scope. Journal of Computer-Aided Molecular Design, 35(4):531-539, 2021. [doi]

Abstract

Abstract is missing.