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2020 2
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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.
Gamboa-Carballo JJ, Ferino-Pérez A, Rana VK, Levalois-Grützmacher J, Gaspard S, Montero-Cabrera LA, Jáuregui-Haza UJ. Gamboa-Carballo JJ, et al. J Chem Inf Model. 2020 Apr 27;60(4):2115-2125. doi: 10.1021/acs.jcim.9b01064. Epub 2020 Mar 16. J Chem Inf Model. 2020. PMID: 32105472