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GARLEEK: Adding an extra flavor to ONIOM
Pedregal, Jaime Rodríguez-Guerra, Funes-Ardoiz, Ignacio, Sciortino, Giuseppe, Sánchez-Aparicio, José-Emilio, Ujaque, Gregori, Lledós, Agustí, Maréchal, Jean-Didie, Maseras, FeliuLanguage:
english
Journal:
Journal of Computational Chemistry
DOI:
10.1002/jcc.25612
Date:
November, 2018
File:
PDF, 1.06 MB
english, 2018