The any particle molecular orbital/molecular mechanics approach

Rodas, JM; Galindo, JF; Roitberg, AE; Reyes, A

Reyes, A (reprint author), Univ Nacl Colombia, Dept Chem, Av Cra 30 45-03, Bogota, Colombia.

JOURNAL OF MOLECULAR MODELING, 2019; 25 (10):

Abstract

A computational scheme is proposed to broaden the range of applications of multicomponent methodologies for the study of local properties of big molec......

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