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da Silva, J.A.V. (author), Modesto-Costa, L. (author), de Koning, M.C. (author), Borges, I.Jr. (author), Fran├ža, T.C.C. (author)
In this work, quaternary and non-quaternary oximes designed to bind at the peripheral site of acetylcholinesterase previously inhibited by organophosphates were investigated theoretically. Some of those oximes have a large number of degrees of freedom, thus requiring an accurate method to obtain molecular geometries. For this reason, the density...
article 2018