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Tuning Mechanically Interlocked Molecules to Recognize Anions and Cations: A Computational Study.
Chemistry. 2023 Jul 20;29(41):e202203905. doi: 10.1002/chem.202203905. Epub 2023 Jun 12.
Chemistry. 2023.
PMID: 36847391
Antifungal activity of Co(II) and Cu(II) complexes containing 1,3-bis(benzotriazol-1-yl)-propan-2-ol on the growth and virulence traits of fluconazole-resistant Candida species: synthesis, DFT calculations, and biological activity.
Murcia-Galán RA, Durán SM, Leal-Pinto SM, Roa-Cordero MV, Vargas JD, Herrera LV, Muñoz-Castro A, MacLeod-Carey D, Naranjo TW, Rodríguez-Kessler PL, Hurtado JJ.
Murcia-Galán RA, et al.
BMC Chem. 2023 Oct 10;17(1):135. doi: 10.1186/s13065-023-01037-7.
BMC Chem. 2023.
PMID: 37817173
Free PMC article.
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New global minimum conformers for the Pt and Pt clusters: low symmetric species featuring different active sites.
Guevara-Vela JM, Gallegos M, Rocha-Rinza T, Muñoz-Castro Á, Kessler PLR, Martín Pendás Á.
Guevara-Vela JM, et al.
J Mol Model. 2024 Aug 17;30(9):310. doi: 10.1007/s00894-024-06099-5.
J Mol Model. 2024.
PMID: 39153076
Free PMC article.
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