"Theoretical Evaluation of the Molecular Inclusion Process between ..."

Juan José Gamboa-Carballo et al. (2020)

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DOI: 10.1021/ACS.JCIM.9B01064

access: closed

type: Journal Article

metadata version: 2022-10-02

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Juan José Gamboa-Carballo, Anthuan Ferino-Pérez, Vijay Kumar Rana, Joëlle Levalois-Grützmacher, Sarra Gaspard, Luis Alberto Montero-Cabrera, Ulises Javier Jáuregui-Haza:
Theoretical Evaluation of the Molecular Inclusion Process between Chlordecone and Cyclodextrins: A New Method for Mitigating the Basis Set Superposition Error in the Case of an Implicit Solvation Model. J. Chem. Inf. Model. 60(4): 2115-2125 (2020)

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