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Infrared Spectroscopy of Liquid Solutions as a Benchmarking Tool of Semiempirical QM Methods: The Case of GFN2-xTB.
J Phys Chem B. 2023 Sep 21;127(37):7955-7963. doi: 10.1021/acs.jpcb.3c03174. Epub 2023 Sep 7.
J Phys Chem B. 2023.
PMID: 37676972
Docking and Molecular Dynamic of Microalgae Compounds as Potential Inhibitors of Beta-Lactamase.
Pestana-Nobles R, Aranguren-Díaz Y, Machado-Sierra E, Yosa J, Galan-Freyle NJ, Sepulveda-Montaño LX, Kuroda DG, Pacheco-Londoño LC.
Pestana-Nobles R, et al. Among authors: sepulveda montano lx.
Int J Mol Sci. 2022 Jan 31;23(3):1630. doi: 10.3390/ijms23031630.
Int J Mol Sci. 2022.
PMID: 35163569
Free PMC article.
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